N-benzhydryl-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide

C23H19N3O2 — CID 7619434

IUPACN-benzhydryl-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide
SMILESCn1c(=O)c(C(=O)NC(c2ccccc2)c2ccccc2)cc2cccnc21
InChIInChI=1S/C23H19N3O2/c1-26-21-18(13-8-14-24-21)15-19(23(26)28)22(27)25-20(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-15,20H,1H3,(H,25,27)
InChIKeyUGRRSVOCNMQLJO-UHFFFAOYSA-N
MW369.42 g/mol
LogP3.45
Rot. Bonds4

About N-benzhydryl-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide

N-benzhydryl-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide (PubChem CID 7619434) has the molecular formula C23H19N3O2 and a molecular weight of 369.42 g/mol. Its IUPAC name is N-benzhydryl-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound NameN-benzhydryl-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide
PubChem CID7619434
Molecular FormulaC23H19N3O2
Molecular Weight369.42 g/mol
Exact Mass369.15
IUPAC NameN-benzhydryl-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide
SMILESCn1c(=O)c(C(=O)NC(c2ccccc2)c2ccccc2)cc2cccnc21
InChIInChI=1S/C23H19N3O2/c1-26-21-18(13-8-14-24-21)15-19(23(26)28)22(27)25-20(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-15,20H,1H3,(H,25,27)
InChIKeyUGRRSVOCNMQLJO-UHFFFAOYSA-N
XLogP3.45
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.42
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-2-oxo-N-[(1S)-1-phenylethyl]-1,8-naphthyridine-3-carboxamide
CID 7619432
1-methyl-2-oxo-N-(4-phenylbutan-2-yl)-1,8-naphthyridine-3-carboxamide
CID 43995808
N-(2-chlorophenyl)-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619491
N-ethyl-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619354
1-methyl-2-oxo-N-(3-phenylpropyl)-1,8-naphthyridine-3-carboxamide
CID 7619447
1-methyl-N-[(1R,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619418
N-[(2,6-difluorophenyl)methyl]-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619615
N-(2,4-difluorophenyl)-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619538
dimethyl-[3-[(1-methyl-2-oxo-1,8-naphthyridine-3-carbonyl)amino]propyl]azanium
CID 7619386
N-(3,3-diphenylpropyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619829
N-ethyl-1-methyl-2-oxo-N-phenyl-1,8-naphthyridine-3-carboxamide
CID 18582865
1-[(2-fluorophenyl)methyl]-2-oxo-N-[(1R)-1-phenylethyl]-1,8-naphthyridine-3-carboxamide
CID 7620990

Frequently Asked Questions

What is the IUPAC name of N-benzhydryl-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide?
The IUPAC name of N-benzhydryl-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide (CID 7619434) is N-benzhydryl-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for N-benzhydryl-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for N-benzhydryl-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide is Cn1c(=O)c(C(=O)NC(c2ccccc2)c2ccccc2)cc2cccnc21.
What is the InChIKey of N-benzhydryl-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide?
The InChIKey is UGRRSVOCNMQLJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O2/c1-26-21-18(13-8-14-24-21)15-19(23(26)28)22(27)25-20(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-15,20H,1H3,(H,25,27).
What are the key properties of N-benzhydryl-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide?
N-benzhydryl-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide has a molecular weight of 369.42 g/mol, XLogP of 3.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzhydryl-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 7619434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).