N-[5-cyano-3-fluoro-4-(3-methoxypropyl)-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1S,2S)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1R,2R)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[7-cyano-2-(methoxymethyl)-2,3-dihydrofuro[3,2-c]pyridin-4-yl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3R,4R)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3S,4S)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

C170H197FN36O35 — CID 163547806

IUPACN-[5-cyano-3-fluoro-4-(3-methoxypropyl)-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1S,2S)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1R,2R)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[7-cyano-2-(methoxymethyl)-2,3-dihydrofuro[3,2-c]pyridin-4-yl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3R,4R)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3S,4S)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESCOCC1Cc2c(NC(=O)N3CCCc4cc(CN(C)C(=O)[C@H]5CCCO5)c(C=O)nc43)ncc(C#N)c2O1.COCCCc1c(C#N)cnc(NC(=O)N2CCCc3cc(CN(C)C(=O)[C@H]4CCCO4)c(C=O)nc32)c1F.CO[C@@H]1CCOC[C@H]1Cc1cc(NC(=O)N2CCCc3cc(CN(C)C(=O)[C@H]4CCCO4)c(C=O)nc32)ncc1C#N.CO[C@@H]1CC[C@H]1Oc1cc(NC(=O)N2CCCc3cc(CN(C)C(=O)[C@H]4CCCO4)c(C=O)nc32)ncc1C#N.CO[C@H]1CCOC[C@@H]1Cc1cc(NC(=O)N2CCCc3cc(CN(C)C(=O)[C@H]4CCCO4)c(C=O)nc32)ncc1C#N.CO[C@H]1CC[C@@H]1Oc1cc(NC(=O)N2CCCc3cc(CN(C)C(=O)[C@H]4CCCO4)c(C=O)nc32)ncc1C#N
InChIInChI=1S/2C30H36N6O6.2C28H32N6O6.C27H31FN6O5.C27H30N6O6/c2*1-35(29(38)26-6-4-9-42-26)16-21-11-19-5-3-8-36(28(19)33-24(21)17-37)30(39)34-27-13-20(23(14-31)15-32-27)12-22-18-41-10-7-25(22)40-2;2*1-33(27(36)23-6-4-10-39-23)15-18-11-17-5-3-9-34(26(17)31-20(18)16-35)28(37)32-25-12-24(19(13-29)14-30-25)40-22-8-7-21(22)38-2;1-33(26(36)22-8-5-11-39-22)15-18-12-17-6-3-9-34(25(17)31-21(18)16-35)27(37)32-24-23(28)20(7-4-10-38-2)19(13-29)14-30-24;1-32(26(35)22-6-4-8-38-22)13-17-9-16-5-3-7-33(25(16)30-21(17)14-34)27(36)31-24-20-10-19(15-37-2)39-23(20)18(11-28)12-29-24/h2*11,13,15,17,22,25-26H,3-10,12,16,18H2,1-2H3,(H,32,34,39);2*11-12,14,16,21-23H,3-10,15H2,1-2H3,(H,30,32,37);12,14,16,22H,3-11,15H2,1-2H3,(H,30,32,37);9,12,14,19,22H,3-8,10,13,15H2,1-2H3,(H,29,31,36)/t22-,25-,26+;22-,25-,26-;21-,22-,23+;21-,22-,23-;22-;19?,22-/m010111/s1
InChIKeyFGNHJLAZCTWGKN-WARNWKDZSA-N
MW3323.66 g/mol
LogP16.67
Rot. Bonds48

About N-[5-cyano-3-fluoro-4-(3-methoxypropyl)-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1S,2S)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1R,2R)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[7-cyano-2-(methoxymethyl)-2,3-dihydrofuro[3,2-c]pyridin-4-yl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3R,4R)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3S,4S)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

N-[5-cyano-3-fluoro-4-(3-methoxypropyl)-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1S,2S)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1R,2R)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[7-cyano-2-(methoxymethyl)-2,3-dihydrofuro[3,2-c]pyridin-4-yl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3R,4R)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3S,4S)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (PubChem CID 163547806) has the molecular formula C170H197FN36O35 and a molecular weight of 3323.66 g/mol. Its IUPAC name is N-[5-cyano-3-fluoro-4-(3-methoxypropyl)-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1S,2S)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1R,2R)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[7-cyano-2-(methoxymethyl)-2,3-dihydrofuro[3,2-c]pyridin-4-yl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3R,4R)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3S,4S)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.

Molecular Properties

Compound NameN-[5-cyano-3-fluoro-4-(3-methoxypropyl)-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1S,2S)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1R,2R)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[7-cyano-2-(methoxymethyl)-2,3-dihydrofuro[3,2-c]pyridin-4-yl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3R,4R)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3S,4S)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
PubChem CID163547806
Molecular FormulaC170H197FN36O35
Molecular Weight3323.66 g/mol
Exact Mass3321.47
IUPAC NameN-[5-cyano-3-fluoro-4-(3-methoxypropyl)-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1S,2S)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1R,2R)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[7-cyano-2-(methoxymethyl)-2,3-dihydrofuro[3,2-c]pyridin-4-yl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3R,4R)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3S,4S)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESCOCC1Cc2c(NC(=O)N3CCCc4cc(CN(C)C(=O)[C@H]5CCCO5)c(C=O)nc43)ncc(C#N)c2O1.COCCCc1c(C#N)cnc(NC(=O)N2CCCc3cc(CN(C)C(=O)[C@H]4CCCO4)c(C=O)nc32)c1F.CO[C@@H]1CCOC[C@H]1Cc1cc(NC(=O)N2CCCc3cc(CN(C)C(=O)[C@H]4CCCO4)c(C=O)nc32)ncc1C#N.CO[C@@H]1CC[C@H]1Oc1cc(NC(=O)N2CCCc3cc(CN(C)C(=O)[C@H]4CCCO4)c(C=O)nc32)ncc1C#N.CO[C@H]1CCOC[C@@H]1Cc1cc(NC(=O)N2CCCc3cc(CN(C)C(=O)[C@H]4CCCO4)c(C=O)nc32)ncc1C#N.CO[C@H]1CC[C@@H]1Oc1cc(NC(=O)N2CCCc3cc(CN(C)C(=O)[C@H]4CCCO4)c(C=O)nc32)ncc1C#N
InChIInChI=1S/2C30H36N6O6.2C28H32N6O6.C27H31FN6O5.C27H30N6O6/c2*1-35(29(38)26-6-4-9-42-26)16-21-11-19-5-3-8-36(28(19)33-24(21)17-37)30(39)34-27-13-20(23(14-31)15-32-27)12-22-18-41-10-7-25(22)40-2;2*1-33(27(36)23-6-4-10-39-23)15-18-11-17-5-3-9-34(26(17)31-20(18)16-35)28(37)32-25-12-24(19(13-29)14-30-25)40-22-8-7-21(22)38-2;1-33(26(36)22-8-5-11-39-22)15-18-12-17-6-3-9-34(25(17)31-21(18)16-35)27(37)32-24-23(28)20(7-4-10-38-2)19(13-29)14-30-24;1-32(26(35)22-6-4-8-38-22)13-17-9-16-5-3-7-33(25(16)30-21(17)14-34)27(36)31-24-20-10-19(15-37-2)39-23(20)18(11-28)12-29-24/h2*11,13,15,17,22,25-26H,3-10,12,16,18H2,1-2H3,(H,32,34,39);2*11-12,14,16,21-23H,3-10,15H2,1-2H3,(H,30,32,37);12,14,16,22H,3-11,15H2,1-2H3,(H,30,32,37);9,12,14,19,22H,3-8,10,13,15H2,1-2H3,(H,29,31,36)/t22-,25-,26+;22-,25-,26-;21-,22-,23+;21-,22-,23-;22-;19?,22-/m010111/s1
InChIKeyFGNHJLAZCTWGKN-WARNWKDZSA-N
XLogP16.67
TPSA872.65 Ų
H-Bond Donors6
H-Bond Acceptors53
Rotatable Bonds48
Heavy Atoms242
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003323.66
LogP ≤ 516.67
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1053

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[5-cyano-3-fluoro-4-(3-methoxypropyl)-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1S,2S)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1R,2R)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[7-cyano-2-(methoxymethyl)-2,3-dihydrofuro[3,2-c]pyridin-4-yl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3R,4R)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3S,4S)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[5-cyano-3-fluoro-4-(3-methoxypropyl)-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1S,2S)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1R,2R)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[7-cyano-2-(methoxymethyl)-2,3-dihydrofuro[3,2-c]pyridin-4-yl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3R,4R)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3S,4S)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The IUPAC name of N-[5-cyano-3-fluoro-4-(3-methoxypropyl)-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1S,2S)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1R,2R)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[7-cyano-2-(methoxymethyl)-2,3-dihydrofuro[3,2-c]pyridin-4-yl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3R,4R)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3S,4S)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (CID 163547806) is N-[5-cyano-3-fluoro-4-(3-methoxypropyl)-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1S,2S)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1R,2R)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[7-cyano-2-(methoxymethyl)-2,3-dihydrofuro[3,2-c]pyridin-4-yl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3R,4R)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3S,4S)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.
What is the SMILES notation for N-[5-cyano-3-fluoro-4-(3-methoxypropyl)-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1S,2S)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1R,2R)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[7-cyano-2-(methoxymethyl)-2,3-dihydrofuro[3,2-c]pyridin-4-yl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3R,4R)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3S,4S)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The canonical SMILES for N-[5-cyano-3-fluoro-4-(3-methoxypropyl)-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1S,2S)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1R,2R)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[7-cyano-2-(methoxymethyl)-2,3-dihydrofuro[3,2-c]pyridin-4-yl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3R,4R)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3S,4S)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is COCC1Cc2c(NC(=O)N3CCCc4cc(CN(C)C(=O)[C@H]5CCCO5)c(C=O)nc43)ncc(C#N)c2O1.COCCCc1c(C#N)cnc(NC(=O)N2CCCc3cc(CN(C)C(=O)[C@H]4CCCO4)c(C=O)nc32)c1F.CO[C@@H]1CCOC[C@H]1Cc1cc(NC(=O)N2CCCc3cc(CN(C)C(=O)[C@H]4CCCO4)c(C=O)nc32)ncc1C#N.CO[C@@H]1CC[C@H]1Oc1cc(NC(=O)N2CCCc3cc(CN(C)C(=O)[C@H]4CCCO4)c(C=O)nc32)ncc1C#N.CO[C@H]1CCOC[C@@H]1Cc1cc(NC(=O)N2CCCc3cc(CN(C)C(=O)[C@H]4CCCO4)c(C=O)nc32)ncc1C#N.CO[C@H]1CC[C@@H]1Oc1cc(NC(=O)N2CCCc3cc(CN(C)C(=O)[C@H]4CCCO4)c(C=O)nc32)ncc1C#N.
What is the InChIKey of N-[5-cyano-3-fluoro-4-(3-methoxypropyl)-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1S,2S)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1R,2R)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[7-cyano-2-(methoxymethyl)-2,3-dihydrofuro[3,2-c]pyridin-4-yl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3R,4R)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3S,4S)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The InChIKey is FGNHJLAZCTWGKN-WARNWKDZSA-N. The full InChI is InChI=1S/2C30H36N6O6.2C28H32N6O6.C27H31FN6O5.C27H30N6O6/c2*1-35(29(38)26-6-4-9-42-26)16-21-11-19-5-3-8-36(28(19)33-24(21)17-37)30(39)34-27-13-20(23(14-31)15-32-27)12-22-18-41-10-7-25(22)40-2;2*1-33(27(36)23-6-4-10-39-23)15-18-11-17-5-3-9-34(26(17)31-20(18)16-35)28(37)32-25-12-24(19(13-29)14-30-25)40-22-8-7-21(22)38-2;1-33(26(36)22-8-5-11-39-22)15-18-12-17-6-3-9-34(25(17)31-21(18)16-35)27(37)32-24-23(28)20(7-4-10-38-2)19(13-29)14-30-24;1-32(26(35)22-6-4-8-38-22)13-17-9-16-5-3-7-33(25(16)30-21(17)14-34)27(36)31-24-20-10-19(15-37-2)39-23(20)18(11-28)12-29-24/h2*11,13,15,17,22,25-26H,3-10,12,16,18H2,1-2H3,(H,32,34,39);2*11-12,14,16,21-23H,3-10,15H2,1-2H3,(H,30,32,37);12,14,16,22H,3-11,15H2,1-2H3,(H,30,32,37);9,12,14,19,22H,3-8,10,13,15H2,1-2H3,(H,29,31,36)/t22-,25-,26+;22-,25-,26-;21-,22-,23+;21-,22-,23-;22-;19?,22-/m010111/s1.
What are the key properties of N-[5-cyano-3-fluoro-4-(3-methoxypropyl)-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1S,2S)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1R,2R)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[7-cyano-2-(methoxymethyl)-2,3-dihydrofuro[3,2-c]pyridin-4-yl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3R,4R)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3S,4S)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
N-[5-cyano-3-fluoro-4-(3-methoxypropyl)-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1S,2S)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1R,2R)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[7-cyano-2-(methoxymethyl)-2,3-dihydrofuro[3,2-c]pyridin-4-yl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3R,4R)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3S,4S)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide has a molecular weight of 3323.66 g/mol, XLogP of 16.67, 48 rotatable bonds, 6 hydrogen bond donors, and 53 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-cyano-3-fluoro-4-(3-methoxypropyl)-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1S,2S)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[(1R,2R)-2-methoxycyclobutyl]oxy-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[7-cyano-2-(methoxymethyl)-2,3-dihydrofuro[3,2-c]pyridin-4-yl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3R,4R)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-[5-cyano-4-[[(3S,4S)-4-methoxyoxan-3-yl]methyl]-2-pyridinyl]-7-formyl-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is sourced from PubChem (CID 163547806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).