2-[[7-[4-[[acetyl(methyl)amino]methyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;N-methyl-5-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]pyridine-2-carboxamide;1-[[4-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]phenyl]methyl]piperidin-2-one

C97H93N15O12 — CID 159728397

IUPAC2-[[7-[4-[[acetyl(methyl)amino]methyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;N-methyl-5-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]pyridine-2-carboxamide;1-[[4-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]phenyl]methyl]piperidin-2-one
SMILESCC(=O)N(C)Cc1ccc(-c2cc(OCc3ncccc3C(N)=O)c3cccnc3c2)cc1.CNC(=O)c1ccc(-c2cc(O[C@H](C)[C@H]3CNC(=O)C3)c3cccnc3c2)cn1.COc1ccc(-c2cc(OCc3ncccc3C(N)=O)c3cccnc3c2)cn1.C[C@@H](Oc1cc(-c2ccc(CN3CCCCC3=O)cc2)cc2ncccc12)[C@H]1CNC(=O)C1
InChIInChI=1S/C27H29N3O3.C26H24N4O3.C22H22N4O3.C22H18N4O3/c1-18(22-15-26(31)29-16-22)33-25-14-21(13-24-23(25)5-4-11-28-24)20-9-7-19(8-10-20)17-30-12-3-2-6-27(30)32;1-17(31)30(2)15-18-7-9-19(10-8-18)20-13-23-21(5-3-11-28-23)25(14-20)33-16-24-22(26(27)32)6-4-12-29-24;1-13(16-10-21(27)26-12-16)29-20-9-15(8-19-17(20)4-3-7-24-19)14-5-6-18(25-11-14)22(28)23-2;1-28-21-7-6-14(12-26-21)15-10-18-16(4-2-8-24-18)20(11-15)29-13-19-17(22(23)27)5-3-9-25-19/h4-5,7-11,13-14,18,22H,2-3,6,12,15-17H2,1H3,(H,29,31);3-14H,15-16H2,1-2H3,(H2,27,32);3-9,11,13,16H,10,12H2,1-2H3,(H,23,28)(H,26,27);2-12H,13H2,1H3,(H2,23,27)/t18-,22-;;13-,16-;/m1.1./s1
InChIKeyNAXOZKCYTJNGOT-UZXYOVBRSA-N
MW1660.90 g/mol
LogP14.21
Rot. Bonds24

About 2-[[7-[4-[[acetyl(methyl)amino]methyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;N-methyl-5-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]pyridine-2-carboxamide;1-[[4-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]phenyl]methyl]piperidin-2-one

2-[[7-[4-[[acetyl(methyl)amino]methyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;N-methyl-5-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]pyridine-2-carboxamide;1-[[4-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]phenyl]methyl]piperidin-2-one (PubChem CID 159728397) has the molecular formula C97H93N15O12 and a molecular weight of 1660.90 g/mol. Its IUPAC name is 2-[[7-[4-[[acetyl(methyl)amino]methyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;N-methyl-5-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]pyridine-2-carboxamide;1-[[4-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]phenyl]methyl]piperidin-2-one.

Molecular Properties

Compound Name2-[[7-[4-[[acetyl(methyl)amino]methyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;N-methyl-5-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]pyridine-2-carboxamide;1-[[4-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]phenyl]methyl]piperidin-2-one
PubChem CID159728397
Molecular FormulaC97H93N15O12
Molecular Weight1660.90 g/mol
Exact Mass1659.71
IUPAC Name2-[[7-[4-[[acetyl(methyl)amino]methyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;N-methyl-5-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]pyridine-2-carboxamide;1-[[4-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]phenyl]methyl]piperidin-2-one
SMILESCC(=O)N(C)Cc1ccc(-c2cc(OCc3ncccc3C(N)=O)c3cccnc3c2)cc1.CNC(=O)c1ccc(-c2cc(O[C@H](C)[C@H]3CNC(=O)C3)c3cccnc3c2)cn1.COc1ccc(-c2cc(OCc3ncccc3C(N)=O)c3cccnc3c2)cn1.C[C@@H](Oc1cc(-c2ccc(CN3CCCCC3=O)cc2)cc2ncccc12)[C@H]1CNC(=O)C1
InChIInChI=1S/C27H29N3O3.C26H24N4O3.C22H22N4O3.C22H18N4O3/c1-18(22-15-26(31)29-16-22)33-25-14-21(13-24-23(25)5-4-11-28-24)20-9-7-19(8-10-20)17-30-12-3-2-6-27(30)32;1-17(31)30(2)15-18-7-9-19(10-8-18)20-13-23-21(5-3-11-28-23)25(14-20)33-16-24-22(26(27)32)6-4-12-29-24;1-13(16-10-21(27)26-12-16)29-20-9-15(8-19-17(20)4-3-7-24-19)14-5-6-18(25-11-14)22(28)23-2;1-28-21-7-6-14(12-26-21)15-10-18-16(4-2-8-24-18)20(11-15)29-13-19-17(22(23)27)5-3-9-25-19/h4-5,7-11,13-14,18,22H,2-3,6,12,15-17H2,1H3,(H,29,31);3-14H,15-16H2,1-2H3,(H2,27,32);3-9,11,13,16H,10,12H2,1-2H3,(H,23,28)(H,26,27);2-12H,13H2,1H3,(H2,23,27)/t18-,22-;;13-,16-;/m1.1./s1
InChIKeyNAXOZKCYTJNGOT-UZXYOVBRSA-N
XLogP14.21
TPSA363.37 Ų
H-Bond Donors5
H-Bond Acceptors20
Rotatable Bonds24
Heavy Atoms124
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001660.90
LogP ≤ 514.21
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1020

Analyze 2-[[7-[4-[[acetyl(methyl)amino]methyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;N-methyl-5-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]pyridine-2-carboxamide;1-[[4-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]phenyl]methyl]piperidin-2-one with MolForge

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Related Compounds

2-[[7-[4-(Morpholin-4-ylmethyl)phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide
CID 71241909
N-methyl-5-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]pyridine-2-carboxamide
CID 71241922
2-[[7-(6-Methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide
CID 71241924
2-[[7-[4-[[Acetyl(methyl)amino]methyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide
CID 71241925
(4R)-4-[(1R)-1-[7-[4-(4-methylpiperazine-1-carbonyl)phenyl]quinolin-5-yl]oxyethyl]pyrrolidin-2-one
CID 71241938
2-[[7-(2-Methylquinolin-6-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide
CID 71241940
2-[[7-[4-[[Acetyl(ethyl)amino]methyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide
CID 71241949
2-[[7-(3-Methyl-4-oxoquinazolin-7-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide
CID 71241961
2-[[7-[6-(Oxan-4-yloxy)-3-pyridinyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide
CID 71241971
3-methyl-7-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]quinazolin-4-one
CID 71241973
2-[[7-(1-oxo-3,4-dihydro-2H-isoquinolin-6-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide
CID 71242059
2-[[7-[4-[(2-Oxopiperidin-1-yl)methyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide
CID 71242061

Frequently Asked Questions

What is the IUPAC name of 2-[[7-[4-[[acetyl(methyl)amino]methyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;N-methyl-5-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]pyridine-2-carboxamide;1-[[4-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]phenyl]methyl]piperidin-2-one?
The IUPAC name of 2-[[7-[4-[[acetyl(methyl)amino]methyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;N-methyl-5-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]pyridine-2-carboxamide;1-[[4-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]phenyl]methyl]piperidin-2-one (CID 159728397) is 2-[[7-[4-[[acetyl(methyl)amino]methyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;N-methyl-5-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]pyridine-2-carboxamide;1-[[4-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]phenyl]methyl]piperidin-2-one.
What is the SMILES notation for 2-[[7-[4-[[acetyl(methyl)amino]methyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;N-methyl-5-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]pyridine-2-carboxamide;1-[[4-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]phenyl]methyl]piperidin-2-one?
The canonical SMILES for 2-[[7-[4-[[acetyl(methyl)amino]methyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;N-methyl-5-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]pyridine-2-carboxamide;1-[[4-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]phenyl]methyl]piperidin-2-one is CC(=O)N(C)Cc1ccc(-c2cc(OCc3ncccc3C(N)=O)c3cccnc3c2)cc1.CNC(=O)c1ccc(-c2cc(O[C@H](C)[C@H]3CNC(=O)C3)c3cccnc3c2)cn1.COc1ccc(-c2cc(OCc3ncccc3C(N)=O)c3cccnc3c2)cn1.C[C@@H](Oc1cc(-c2ccc(CN3CCCCC3=O)cc2)cc2ncccc12)[C@H]1CNC(=O)C1.
What is the InChIKey of 2-[[7-[4-[[acetyl(methyl)amino]methyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;N-methyl-5-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]pyridine-2-carboxamide;1-[[4-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]phenyl]methyl]piperidin-2-one?
The InChIKey is NAXOZKCYTJNGOT-UZXYOVBRSA-N. The full InChI is InChI=1S/C27H29N3O3.C26H24N4O3.C22H22N4O3.C22H18N4O3/c1-18(22-15-26(31)29-16-22)33-25-14-21(13-24-23(25)5-4-11-28-24)20-9-7-19(8-10-20)17-30-12-3-2-6-27(30)32;1-17(31)30(2)15-18-7-9-19(10-8-18)20-13-23-21(5-3-11-28-23)25(14-20)33-16-24-22(26(27)32)6-4-12-29-24;1-13(16-10-21(27)26-12-16)29-20-9-15(8-19-17(20)4-3-7-24-19)14-5-6-18(25-11-14)22(28)23-2;1-28-21-7-6-14(12-26-21)15-10-18-16(4-2-8-24-18)20(11-15)29-13-19-17(22(23)27)5-3-9-25-19/h4-5,7-11,13-14,18,22H,2-3,6,12,15-17H2,1H3,(H,29,31);3-14H,15-16H2,1-2H3,(H2,27,32);3-9,11,13,16H,10,12H2,1-2H3,(H,23,28)(H,26,27);2-12H,13H2,1H3,(H2,23,27)/t18-,22-;;13-,16-;/m1.1./s1.
What are the key properties of 2-[[7-[4-[[acetyl(methyl)amino]methyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;N-methyl-5-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]pyridine-2-carboxamide;1-[[4-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]phenyl]methyl]piperidin-2-one?
2-[[7-[4-[[acetyl(methyl)amino]methyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;N-methyl-5-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]pyridine-2-carboxamide;1-[[4-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]phenyl]methyl]piperidin-2-one has a molecular weight of 1660.90 g/mol, XLogP of 14.21, 24 rotatable bonds, 5 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[7-[4-[[acetyl(methyl)amino]methyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;2-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;N-methyl-5-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]pyridine-2-carboxamide;1-[[4-[5-[(1R)-1-[(3R)-5-oxopyrrolidin-3-yl]ethoxy]quinolin-7-yl]phenyl]methyl]piperidin-2-one is sourced from PubChem (CID 159728397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).