N-cyclopropyl-4-oxo-1-[3-(6-phenylmethoxy-3-pyridinyl)phenyl]-1,8-naphthyridine-3-carboxamide

C30H24N4O3 — CID 10299946

IUPACN-cyclopropyl-4-oxo-1-[3-(6-phenylmethoxy-3-pyridinyl)phenyl]-1,8-naphthyridine-3-carboxamide
SMILESO=C(NC1CC1)c1cn(-c2cccc(-c3ccc(OCc4ccccc4)nc3)c2)c2ncccc2c1=O
InChIInChI=1S/C30H24N4O3/c35-28-25-10-5-15-31-29(25)34(18-26(28)30(36)33-23-12-13-23)24-9-4-8-21(16-24)22-11-14-27(32-17-22)37-19-20-6-2-1-3-7-20/h1-11,14-18,23H,12-13,19H2,(H,33,36)
InChIKeyLOFDNGMMMXFQJV-UHFFFAOYSA-N
MW488.55 g/mol
LogP4.92
Rot. Bonds7

About N-cyclopropyl-4-oxo-1-[3-(6-phenylmethoxy-3-pyridinyl)phenyl]-1,8-naphthyridine-3-carboxamide

N-cyclopropyl-4-oxo-1-[3-(6-phenylmethoxy-3-pyridinyl)phenyl]-1,8-naphthyridine-3-carboxamide (PubChem CID 10299946) has the molecular formula C30H24N4O3 and a molecular weight of 488.55 g/mol. Its IUPAC name is N-cyclopropyl-4-oxo-1-[3-(6-phenylmethoxy-3-pyridinyl)phenyl]-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-4-oxo-1-[3-(6-phenylmethoxy-3-pyridinyl)phenyl]-1,8-naphthyridine-3-carboxamide
PubChem CID10299946
Molecular FormulaC30H24N4O3
Molecular Weight488.55 g/mol
Exact Mass488.18
IUPAC NameN-cyclopropyl-4-oxo-1-[3-(6-phenylmethoxy-3-pyridinyl)phenyl]-1,8-naphthyridine-3-carboxamide
SMILESO=C(NC1CC1)c1cn(-c2cccc(-c3ccc(OCc4ccccc4)nc3)c2)c2ncccc2c1=O
InChIInChI=1S/C30H24N4O3/c35-28-25-10-5-15-31-29(25)34(18-26(28)30(36)33-23-12-13-23)24-9-4-8-21(16-24)22-11-14-27(32-17-22)37-19-20-6-2-1-3-7-20/h1-11,14-18,23H,12-13,19H2,(H,33,36)
InChIKeyLOFDNGMMMXFQJV-UHFFFAOYSA-N
XLogP4.92
TPSA86.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms37
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500488.55
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-cyclopropyl-4-oxo-1-[3-(6-phenylmethoxy-3-pyridinyl)phenyl]-1,8-naphthyridine-3-carboxamide with MolForge

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Related Compounds

Amg-487
CID 24957182
(3R,4R)-N-Cyclohexyl-4-[[5-(2-furanyl)-1,2-dihydro-3-methyl-2-oxo-1,7-naphthyridin-8-yl]amino]-1-methyl-3-piperidinecarboxamide
CID 146681130
N-(4-phenoxyphenyl)-2-((pyridin-4-ylmethyl)amino)nicotinamide
CID 16040289
rac-NBI-74330
CID 10167713
Nbi-74330
CID 45784923
N-(3-isopropylphenyl)-4-methyl-3-(3-(4-(methylamino)-1,3,5-triazin-2-yl)pyridin-2-yloxy)benzamide
CID 44440292
6-amino-5-methyl-N-[4-[[3-[5-(trifluoromethyl)pyridin-2-yl]oxyphenyl]methylidene]cyclohexyl]pyridine-3-carboxamide
CID 71544354
6-amino-N-[4-[[3-[[5-(trifluoromethyl)-2-pyridyl]oxy]-phenyl]methylene]cyclohexyl]pyridine-3-carboxamide
CID 89462922
Nevirapin 4-substituted deriv. 4c
CID 464523
Nevirapin 2,4-Disubstituted deriv. 13g
CID 464573
5-[(4-Fluoranyl-3-Phenoxy-Phenyl)methylamino]-~{n}-Methyl-6-[(1-Pyridin-2-Ylpiperidin-4-Yl)amino]pyridine-3-Carboxamide
CID 122391194
1-[(4-fluorophenyl)methyl]-6-(furan-2-yl)-N-(4-methylcyclohexyl)-2-oxo-1,8-naphthyridine-3-carboxamide
CID 118719605

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-oxo-1-[3-(6-phenylmethoxy-3-pyridinyl)phenyl]-1,8-naphthyridine-3-carboxamide?
The IUPAC name of N-cyclopropyl-4-oxo-1-[3-(6-phenylmethoxy-3-pyridinyl)phenyl]-1,8-naphthyridine-3-carboxamide (CID 10299946) is N-cyclopropyl-4-oxo-1-[3-(6-phenylmethoxy-3-pyridinyl)phenyl]-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-4-oxo-1-[3-(6-phenylmethoxy-3-pyridinyl)phenyl]-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-4-oxo-1-[3-(6-phenylmethoxy-3-pyridinyl)phenyl]-1,8-naphthyridine-3-carboxamide is O=C(NC1CC1)c1cn(-c2cccc(-c3ccc(OCc4ccccc4)nc3)c2)c2ncccc2c1=O.
What is the InChIKey of N-cyclopropyl-4-oxo-1-[3-(6-phenylmethoxy-3-pyridinyl)phenyl]-1,8-naphthyridine-3-carboxamide?
The InChIKey is LOFDNGMMMXFQJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H24N4O3/c35-28-25-10-5-15-31-29(25)34(18-26(28)30(36)33-23-12-13-23)24-9-4-8-21(16-24)22-11-14-27(32-17-22)37-19-20-6-2-1-3-7-20/h1-11,14-18,23H,12-13,19H2,(H,33,36).
What are the key properties of N-cyclopropyl-4-oxo-1-[3-(6-phenylmethoxy-3-pyridinyl)phenyl]-1,8-naphthyridine-3-carboxamide?
N-cyclopropyl-4-oxo-1-[3-(6-phenylmethoxy-3-pyridinyl)phenyl]-1,8-naphthyridine-3-carboxamide has a molecular weight of 488.55 g/mol, XLogP of 4.92, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-oxo-1-[3-(6-phenylmethoxy-3-pyridinyl)phenyl]-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 10299946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).