3-[3-[3-hydroxy-3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-[3-[3-(7-hydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;3-(6-oxo-1H-pyridin-3-yl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid

C114H137N25O23 — CID 161411056

IUPAC3-[3-[3-hydroxy-3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-[3-[3-(7-hydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;3-(6-oxo-1H-pyridin-3-yl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid
SMILESCOc1ccc(C(CC(=O)O)N2CCN(CCC(O)c3ccc4c(n3)NCCC4)C2=O)cn1.COc1ccc(C(CC(=O)O)N2CCN(CCCc3ccc4c(n3)NC(=O)CC4)C2=O)cn1.COc1ccc(C(CC(=O)O)N2CCN(CCCc3ccc4c(n3)NC(O)CC4)C2=O)cn1.COc1ccc(C(CC(=O)O)N2CCN(CCCc3ccc4cccnc4n3)C2=O)cn1.O=C(O)CC(c1ccc(=O)[nH]c1)N1CCN(CCCc2ccc3c(n2)NCCC3)C1=O
InChIInChI=1S/C23H29N5O5.C23H27N5O5.C23H29N5O5.C23H25N5O4.C22H27N5O4/c2*1-33-20-9-6-16(14-24-20)18(13-21(30)31)28-12-11-27(23(28)32)10-2-3-17-7-4-15-5-8-19(29)26-22(15)25-17;1-33-20-7-5-16(14-25-20)18(13-21(30)31)28-12-11-27(23(28)32)10-8-19(29)17-6-4-15-3-2-9-24-22(15)26-17;1-32-20-9-7-17(15-25-20)19(14-21(29)30)28-13-12-27(23(28)31)11-3-5-18-8-6-16-4-2-10-24-22(16)26-18;28-19-8-6-16(14-24-19)18(13-20(29)30)27-12-11-26(22(27)31)10-2-4-17-7-5-15-3-1-9-23-21(15)25-17/h4,6-7,9,14,18-19,29H,2-3,5,8,10-13H2,1H3,(H,25,26)(H,30,31);4,6-7,9,14,18H,2-3,5,8,10-13H2,1H3,(H,30,31)(H,25,26,29);4-7,14,18-19,29H,2-3,8-13H2,1H3,(H,24,26)(H,30,31);2,4,6-10,15,19H,3,5,11-14H2,1H3,(H,29,30);5-8,14,18H,1-4,9-13H2,(H,23,25)(H,24,28)(H,29,30)
InChIKeyVVLYBKGVBOOVRP-UHFFFAOYSA-N
MW2225.50 g/mol
LogP11.46
Rot. Bonds44

About 3-[3-[3-hydroxy-3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-[3-[3-(7-hydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;3-(6-oxo-1H-pyridin-3-yl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid

3-[3-[3-hydroxy-3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-[3-[3-(7-hydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;3-(6-oxo-1H-pyridin-3-yl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid (PubChem CID 161411056) has the molecular formula C114H137N25O23 and a molecular weight of 2225.50 g/mol. Its IUPAC name is 3-[3-[3-hydroxy-3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-[3-[3-(7-hydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;3-(6-oxo-1H-pyridin-3-yl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid.

Molecular Properties

Compound Name3-[3-[3-hydroxy-3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-[3-[3-(7-hydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;3-(6-oxo-1H-pyridin-3-yl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid
PubChem CID161411056
Molecular FormulaC114H137N25O23
Molecular Weight2225.50 g/mol
Exact Mass2224.03
IUPAC Name3-[3-[3-hydroxy-3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-[3-[3-(7-hydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;3-(6-oxo-1H-pyridin-3-yl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid
SMILESCOc1ccc(C(CC(=O)O)N2CCN(CCC(O)c3ccc4c(n3)NCCC4)C2=O)cn1.COc1ccc(C(CC(=O)O)N2CCN(CCCc3ccc4c(n3)NC(=O)CC4)C2=O)cn1.COc1ccc(C(CC(=O)O)N2CCN(CCCc3ccc4c(n3)NC(O)CC4)C2=O)cn1.COc1ccc(C(CC(=O)O)N2CCN(CCCc3ccc4cccnc4n3)C2=O)cn1.O=C(O)CC(c1ccc(=O)[nH]c1)N1CCN(CCCc2ccc3c(n2)NCCC3)C1=O
InChIInChI=1S/C23H29N5O5.C23H27N5O5.C23H29N5O5.C23H25N5O4.C22H27N5O4/c2*1-33-20-9-6-16(14-24-20)18(13-21(30)31)28-12-11-27(23(28)32)10-2-3-17-7-4-15-5-8-19(29)26-22(15)25-17;1-33-20-7-5-16(14-25-20)18(13-21(30)31)28-12-11-27(23(28)32)10-8-19(29)17-6-4-15-3-2-9-24-22(15)26-17;1-32-20-9-7-17(15-25-20)19(14-21(29)30)28-13-12-27(23(28)31)11-3-5-18-8-6-16-4-2-10-24-22(16)26-18;28-19-8-6-16(14-24-19)18(13-20(29)30)27-12-11-26(22(27)31)10-2-4-17-7-5-15-3-1-9-23-21(15)25-17/h4,6-7,9,14,18-19,29H,2-3,5,8,10-13H2,1H3,(H,25,26)(H,30,31);4,6-7,9,14,18H,2-3,5,8,10-13H2,1H3,(H,30,31)(H,25,26,29);4-7,14,18-19,29H,2-3,8-13H2,1H3,(H,24,26)(H,30,31);2,4,6-10,15,19H,3,5,11-14H2,1H3,(H,29,30);5-8,14,18H,1-4,9-13H2,(H,23,25)(H,24,28)(H,29,30)
InChIKeyVVLYBKGVBOOVRP-UHFFFAOYSA-N
XLogP11.46
TPSA608.58 Ų
H-Bond Donors12
H-Bond Acceptors31
Rotatable Bonds44
Heavy Atoms162
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002225.50
LogP ≤ 511.46
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1031

Analyze 3-[3-[3-hydroxy-3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-[3-[3-(7-hydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;3-(6-oxo-1H-pyridin-3-yl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid with MolForge

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Launch Full Analysis

Related Compounds

sodium;2-aminopyridine-3-carbaldehyde;tert-butyl 3-[6-(difluoromethoxy)-3-pyridinyl]-3-[2-oxo-3-[3-(5,6,7,8-tetrahydroquinolin-2-yl)propyl]imidazolidin-1-yl]propanoate;tert-butyl N-(5-dimethylphosphoryl-4-oxopentyl)carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;tert-butyl N-[3-(1,8-naphthyridin-2-yl)propyl]carbamate;tert-butyl 2-oxopyrrolidine-1-carboxylate;tert-butyl N-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]carbamate;3-[6-(difluoromethoxy)-3-pyridinyl]-3-[2-oxo-3-[3-(5,6,7,8-tetrahydroquinolin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;methane;pyrrolidin-2-one;3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propan-1-amine;2,2,2-trifluoroacetaldehyde;hydroxide
CID 160472088
sodium;2-aminopyridine-3-carbaldehyde;tert-butyl N-(5-dimethylphosphoryl-4-oxopentyl)carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;tert-butyl N-[3-(1,8-naphthyridin-2-yl)propyl]carbamate;tert-butyl 2-oxopyrrolidine-1-carboxylate;tert-butyl N-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]carbamate;3-[6-(difluoromethoxy)-3-pyridinyl]-3-[2-oxo-3-[3-(5,6,7,8-tetrahydroquinolin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;methane;pyrrolidin-2-one;3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propan-1-amine;hydroxide
CID 157219456
(3S)-3-(6-methoxy-3-pyridinyl)-3-[1-oxo-7-[2-(1,2,3,4-tetrahydro-1,8-naphthyridin-2-yl)ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-2-yl]propanoic acid
CID 157256849
Propan-2-yl 2-[[6-[2-(dimethylamino)ethyl-methylamino]-2-methoxy-5-(prop-2-enoylamino)-3-pyridinyl]methyl]-4-(1-methylpyrrolo[2,3-b]pyridin-3-yl)pyrimidine-5-carboxylate;propan-2-yl 2-[[6-[2-(dimethylamino)ethyl-methylamino]-2-methoxy-5-(prop-2-enoylamino)-3-pyridinyl]methyl]-4-(1-methylpyrrolo[3,2-b]pyridin-3-yl)pyrimidine-5-carboxylate;propan-2-yl 2-[[6-[2-(dimethylamino)ethyl-methylamino]-2-methoxy-5-(prop-2-enoylamino)-3-pyridinyl]methyl]-4-(1-methylpyrrolo[2,3-c]pyridin-3-yl)pyrimidine-5-carboxylate;propan-2-yl 2-[[6-[2-(dimethylamino)ethyl-methylamino]-2-methoxy-5-(prop-2-enoylamino)-3-pyridinyl]methyl]-4-(1-methylpyrrolo[3,2-c]pyridin-3-yl)pyrimidine-5-carboxylate
CID 157380658
1-O-tert-butyl 2-O-ethyl 4-[(E)-2-(1,8-naphthyridin-2-yl)ethenyl]pyrrole-1,2-dicarboxylate;1-O-tert-butyl 2-O-ethyl 4-[(E)-2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethenyl]pyrrole-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;ethanol;ethyl (2S)-3-amino-2-(phenylmethoxycarbonylamino)propanoate;ethyl 4-[(E)-2-(1,8-naphthyridin-2-yl)ethenyl]-1H-pyrrole-2-carboxylate;(2S)-2-(phenylmethoxycarbonylamino)-3-[[4-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethyl]-1H-pyrrole-2-carbonyl]amino]propanoic acid;4-[(E)-2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethenyl]-1H-pyrrole-2-carboxylic acid
CID 157591482
(3S)-3-[3-[3-hydroxy-3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;(3S)-3-[3-[3-(7-hydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;(3S)-3-(6-methoxy-3-pyridinyl)-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]propanoic acid;(3S)-3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;(3S)-3-(6-oxo-1H-pyridin-3-yl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;3,4,5-trihydroxy-6-[(3S)-3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoyl]oxyoxane-2-carboxylic acid
CID 157895171
1-O-tert-butyl 2-O-ethyl 4-[(E)-2-(1,8-naphthyridin-2-yl)ethenyl]pyrrole-1,2-dicarboxylate;1-O-tert-butyl 2-O-ethyl 4-[(E)-2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethenyl]pyrrole-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;ethanol;ethyl 4-[(E)-2-(1,8-naphthyridin-2-yl)ethenyl]-1H-pyrrole-2-carboxylate;methyl (2S)-3-amino-2-(phenylmethoxycarbonylamino)propanoate;(2S)-2-(phenylmethoxycarbonylamino)-3-[[4-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethyl]-1H-pyrrole-2-carbonyl]amino]propanoic acid;4-[(E)-2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethenyl]-1H-pyrrole-2-carboxylic acid
CID 157982711
3-[3-[3-(5,7-Dihydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;1-[3-hydroxy-3-(5-hydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-3-[1-(6-methoxy-3-pyridinyl)propyl]imidazolidin-2-one;3-[3-[3-hydroxy-3-(7-hydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid
CID 158036294
ethyl (3S)-3-amino-3-(3-fluoro-4-methoxyphenyl)propanoate;ethyl (3S)-3-(3-fluoro-4-methoxyphenyl)-3-[7-[(E)-2-(1,8-naphthyridin-2-yl)ethenyl]-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-2-yl]propanoate;ethyl (3S)-3-(3-fluoro-4-methoxyphenyl)-3-[[4-[(E)-2-(1,8-naphthyridin-2-yl)ethenyl]-1H-pyrrole-2-carbonyl]amino]propanoate;ethyl (3S)-3-(3-fluoro-4-methoxyphenyl)-3-[1-oxo-7-[2-(1,2,3,4-tetrahydro-1,8-naphthyridin-2-yl)ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-2-yl]propanoate;ethyl (3S)-3-(3-fluoro-4-methoxyphenyl)-3-[1-oxo-7-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-2-yl]propanoate;(3S)-3-(3-fluoro-4-methoxyphenyl)-3-[1-oxo-7-[2-(1,2,3,4-tetrahydro-1,8-naphthyridin-2-yl)ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-2-yl]propanoic acid;4-[(E)-2-(1,8-naphthyridin-2-yl)ethenyl]-1H-pyrrole-2-carboxylic acid;hydrochloride
CID 159164369
6-tert-butyl-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b][1,4]oxazine;1-(2-tert-butyl-3,4,6,7,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-8-yl)ethanone;2-tert-butyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine;tert-butyl 2-tert-butyl-3,4,6,7,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazine-8-carboxylate;7-tert-butyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2-tert-butyl-3,4-dihydro-1H-2,7-naphthyridine;7-tert-butyl-6,8-dihydro-5H-1,7-naphthyridine;2-tert-butyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine;2-tert-butyl-7-methoxy-3,4-dihydro-1H-2,6-naphthyridine;2-[tert-butyl(2-methoxyethyl)amino]ethanol;1-tert-butyl-4-(2-methoxyethyl)piperazin-2-one;4-tert-butyl-1-(2-methoxyethyl)piperazin-2-one;1-tert-butyl-2-methylpiperidine;5-tert-butyl-2-oxa-5-azabicyclo[2.2.1]heptane;methyl 3-(2-tert-butyl-3,4,6,7,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-8-yl)propanoate
CID 159198171
3-(6-Methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazol-1-yl]propanoic acid;molecular hydrogen
CID 159265707
tert-butyl N-(5-formyl-2-pyridinyl)-N-[(6-methoxy-3-pyridinyl)methyl]carbamate;tert-butyl N-[5-[hydroxy(7H-pyrrolo[2,3-d]pyrimidin-5-yl)methyl]-2-pyridinyl]-N-[(6-methoxy-3-pyridinyl)methyl]carbamate;tert-butyl N-[(6-methoxy-3-pyridinyl)methyl]-N-[5-(7H-pyrrolo[2,3-d]pyrimidine-5-carbonyl)-2-pyridinyl]carbamate;[6-[2-(6-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)methanone;7H-pyrrolo[2,3-d]pyrimidine
CID 159663666

Frequently Asked Questions

What is the IUPAC name of 3-[3-[3-hydroxy-3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-[3-[3-(7-hydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;3-(6-oxo-1H-pyridin-3-yl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid?
The IUPAC name of 3-[3-[3-hydroxy-3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-[3-[3-(7-hydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;3-(6-oxo-1H-pyridin-3-yl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid (CID 161411056) is 3-[3-[3-hydroxy-3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-[3-[3-(7-hydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;3-(6-oxo-1H-pyridin-3-yl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid.
What is the SMILES notation for 3-[3-[3-hydroxy-3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-[3-[3-(7-hydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;3-(6-oxo-1H-pyridin-3-yl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid?
The canonical SMILES for 3-[3-[3-hydroxy-3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-[3-[3-(7-hydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;3-(6-oxo-1H-pyridin-3-yl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid is COc1ccc(C(CC(=O)O)N2CCN(CCC(O)c3ccc4c(n3)NCCC4)C2=O)cn1.COc1ccc(C(CC(=O)O)N2CCN(CCCc3ccc4c(n3)NC(=O)CC4)C2=O)cn1.COc1ccc(C(CC(=O)O)N2CCN(CCCc3ccc4c(n3)NC(O)CC4)C2=O)cn1.COc1ccc(C(CC(=O)O)N2CCN(CCCc3ccc4cccnc4n3)C2=O)cn1.O=C(O)CC(c1ccc(=O)[nH]c1)N1CCN(CCCc2ccc3c(n2)NCCC3)C1=O.
What is the InChIKey of 3-[3-[3-hydroxy-3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-[3-[3-(7-hydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;3-(6-oxo-1H-pyridin-3-yl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid?
The InChIKey is VVLYBKGVBOOVRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N5O5.C23H27N5O5.C23H29N5O5.C23H25N5O4.C22H27N5O4/c2*1-33-20-9-6-16(14-24-20)18(13-21(30)31)28-12-11-27(23(28)32)10-2-3-17-7-4-15-5-8-19(29)26-22(15)25-17;1-33-20-7-5-16(14-25-20)18(13-21(30)31)28-12-11-27(23(28)32)10-8-19(29)17-6-4-15-3-2-9-24-22(15)26-17;1-32-20-9-7-17(15-25-20)19(14-21(29)30)28-13-12-27(23(28)31)11-3-5-18-8-6-16-4-2-10-24-22(16)26-18;28-19-8-6-16(14-24-19)18(13-20(29)30)27-12-11-26(22(27)31)10-2-4-17-7-5-15-3-1-9-23-21(15)25-17/h4,6-7,9,14,18-19,29H,2-3,5,8,10-13H2,1H3,(H,25,26)(H,30,31);4,6-7,9,14,18H,2-3,5,8,10-13H2,1H3,(H,30,31)(H,25,26,29);4-7,14,18-19,29H,2-3,8-13H2,1H3,(H,24,26)(H,30,31);2,4,6-10,15,19H,3,5,11-14H2,1H3,(H,29,30);5-8,14,18H,1-4,9-13H2,(H,23,25)(H,24,28)(H,29,30).
What are the key properties of 3-[3-[3-hydroxy-3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-[3-[3-(7-hydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;3-(6-oxo-1H-pyridin-3-yl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid?
3-[3-[3-hydroxy-3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-[3-[3-(7-hydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;3-(6-oxo-1H-pyridin-3-yl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid has a molecular weight of 2225.50 g/mol, XLogP of 11.46, 44 rotatable bonds, 12 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-[3-hydroxy-3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-[3-[3-(7-hydroxy-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]-3-(6-methoxy-3-pyridinyl)propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-2-oxoimidazolidin-1-yl]propanoic acid;3-(6-methoxy-3-pyridinyl)-3-[2-oxo-3-[3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid;3-(6-oxo-1H-pyridin-3-yl)-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid is sourced from PubChem (CID 161411056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).