6-[[7-methoxy-4-(1-methoxynaphthalen-2-yl)-2-oxoquinolin-1-yl]methyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide

C34H28N4O4 — CID 139956895

IUPAC6-[[7-methoxy-4-(1-methoxynaphthalen-2-yl)-2-oxoquinolin-1-yl]methyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
SMILESCOc1ccc2c(-c3ccc4ccccc4c3OC)cc(=O)n(Cc3ccc(C(=O)NCc4cccnc4)cn3)c2c1
InChIInChI=1S/C34H28N4O4/c1-41-26-12-14-28-30(29-13-10-23-7-3-4-8-27(23)33(29)42-2)17-32(39)38(31(28)16-26)21-25-11-9-24(20-36-25)34(40)37-19-22-6-5-15-35-18-22/h3-18,20H,19,21H2,1-2H3,(H,37,40)
InChIKeyACKGILPSOPRTBO-UHFFFAOYSA-N
MW556.62 g/mol
LogP5.61
Rot. Bonds8

About 6-[[7-methoxy-4-(1-methoxynaphthalen-2-yl)-2-oxoquinolin-1-yl]methyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide

6-[[7-methoxy-4-(1-methoxynaphthalen-2-yl)-2-oxoquinolin-1-yl]methyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide (PubChem CID 139956895) has the molecular formula C34H28N4O4 and a molecular weight of 556.62 g/mol. Its IUPAC name is 6-[[7-methoxy-4-(1-methoxynaphthalen-2-yl)-2-oxoquinolin-1-yl]methyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[[7-methoxy-4-(1-methoxynaphthalen-2-yl)-2-oxoquinolin-1-yl]methyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
PubChem CID139956895
Molecular FormulaC34H28N4O4
Molecular Weight556.62 g/mol
Exact Mass556.21
IUPAC Name6-[[7-methoxy-4-(1-methoxynaphthalen-2-yl)-2-oxoquinolin-1-yl]methyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
SMILESCOc1ccc2c(-c3ccc4ccccc4c3OC)cc(=O)n(Cc3ccc(C(=O)NCc4cccnc4)cn3)c2c1
InChIInChI=1S/C34H28N4O4/c1-41-26-12-14-28-30(29-13-10-23-7-3-4-8-27(23)33(29)42-2)17-32(39)38(31(28)16-26)21-25-11-9-24(20-36-25)34(40)37-19-22-6-5-15-35-18-22/h3-18,20H,19,21H2,1-2H3,(H,37,40)
InChIKeyACKGILPSOPRTBO-UHFFFAOYSA-N
XLogP5.61
TPSA95.34 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500556.62
LogP ≤ 55.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 6-[[7-methoxy-4-(1-methoxynaphthalen-2-yl)-2-oxoquinolin-1-yl]methyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide with MolForge

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Related Compounds

1-benzyl-6-methoxy-2-propan-2-yl-N-(pyridin-3-ylmethyl)indole-3-carboxamide
CID 123570891
6-(2,5-dimethoxyanilino)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 109157978
6-[(4-methoxyphenyl)methylamino]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 109157222
3-(2,5-dimethoxyphenyl)-4-oxo-N-(pyridin-3-ylmethyl)quinazoline-7-carboxamide
CID 39048130
4-N-(3-methoxyphenyl)-1-N-(pyridin-3-ylmethyl)benzene-1,4-dicarboxamide
CID 109047690
1-acetyl-5-methoxy-N-(pyridin-3-ylmethyl)indole-3-carboxamide
CID 113212725
N-[(3,5-dimethoxyphenyl)methyl]-4-(pyridin-3-ylmethoxy)benzamide
CID 46590121
2,3-bis(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)quinoxaline-6-carboxamide
CID 5073153
4-ethoxy-N-(pyridin-3-ylmethyl)benzamide
CID 673607
2-[(4-methoxybenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide
CID 991450
1-methyl-N-(pyridin-3-ylmethyl)indazole-6-carboxamide
CID 110475596
7-methoxy-N-(pyridin-3-ylmethyl)-4,5-dihydro-2H-benzo[g]indazole-3-carboxamide
CID 20954035

Frequently Asked Questions

What is the IUPAC name of 6-[[7-methoxy-4-(1-methoxynaphthalen-2-yl)-2-oxoquinolin-1-yl]methyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 6-[[7-methoxy-4-(1-methoxynaphthalen-2-yl)-2-oxoquinolin-1-yl]methyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide (CID 139956895) is 6-[[7-methoxy-4-(1-methoxynaphthalen-2-yl)-2-oxoquinolin-1-yl]methyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-[[7-methoxy-4-(1-methoxynaphthalen-2-yl)-2-oxoquinolin-1-yl]methyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 6-[[7-methoxy-4-(1-methoxynaphthalen-2-yl)-2-oxoquinolin-1-yl]methyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide is COc1ccc2c(-c3ccc4ccccc4c3OC)cc(=O)n(Cc3ccc(C(=O)NCc4cccnc4)cn3)c2c1.
What is the InChIKey of 6-[[7-methoxy-4-(1-methoxynaphthalen-2-yl)-2-oxoquinolin-1-yl]methyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide?
The InChIKey is ACKGILPSOPRTBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H28N4O4/c1-41-26-12-14-28-30(29-13-10-23-7-3-4-8-27(23)33(29)42-2)17-32(39)38(31(28)16-26)21-25-11-9-24(20-36-25)34(40)37-19-22-6-5-15-35-18-22/h3-18,20H,19,21H2,1-2H3,(H,37,40).
What are the key properties of 6-[[7-methoxy-4-(1-methoxynaphthalen-2-yl)-2-oxoquinolin-1-yl]methyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide?
6-[[7-methoxy-4-(1-methoxynaphthalen-2-yl)-2-oxoquinolin-1-yl]methyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide has a molecular weight of 556.62 g/mol, XLogP of 5.61, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[7-methoxy-4-(1-methoxynaphthalen-2-yl)-2-oxoquinolin-1-yl]methyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 139956895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).