N,6-dibenzyl-4-oxo-1H-1,5-naphthyridine-3-carboxamide

C23H19N3O2 — CID 10109646

IUPACN,6-dibenzyl-4-oxo-1H-1,5-naphthyridine-3-carboxamide
SMILESO=C(NCc1ccccc1)c1c[nH]c2ccc(Cc3ccccc3)nc2c1=O
InChIInChI=1S/C23H19N3O2/c27-22-19(23(28)25-14-17-9-5-2-6-10-17)15-24-20-12-11-18(26-21(20)22)13-16-7-3-1-4-8-16/h1-12,15H,13-14H2,(H,24,27)(H,25,28)
InChIKeyMIKYRWDOCJFBST-UHFFFAOYSA-N
MW369.42 g/mol
LogP3.44
Rot. Bonds5

About N,6-dibenzyl-4-oxo-1H-1,5-naphthyridine-3-carboxamide

N,6-dibenzyl-4-oxo-1H-1,5-naphthyridine-3-carboxamide (PubChem CID 10109646) has the molecular formula C23H19N3O2 and a molecular weight of 369.42 g/mol. Its IUPAC name is N,6-dibenzyl-4-oxo-1H-1,5-naphthyridine-3-carboxamide.

Molecular Properties

Compound NameN,6-dibenzyl-4-oxo-1H-1,5-naphthyridine-3-carboxamide
PubChem CID10109646
Molecular FormulaC23H19N3O2
Molecular Weight369.42 g/mol
Exact Mass369.15
IUPAC NameN,6-dibenzyl-4-oxo-1H-1,5-naphthyridine-3-carboxamide
SMILESO=C(NCc1ccccc1)c1c[nH]c2ccc(Cc3ccccc3)nc2c1=O
InChIInChI=1S/C23H19N3O2/c27-22-19(23(28)25-14-17-9-5-2-6-10-17)15-24-20-12-11-18(26-21(20)22)13-16-7-3-1-4-8-16/h1-12,15H,13-14H2,(H,24,27)(H,25,28)
InChIKeyMIKYRWDOCJFBST-UHFFFAOYSA-N
XLogP3.44
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.42
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-oxo-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-1H-quinoline-3-carboxamide
CID 60553799
N-benzyl-6-methoxy-4-oxo-1H-quinoline-3-carboxamide
CID 18473067
N-[[4-[(dimethylamino)methyl]phenyl]methyl]-6-ethoxy-4-oxo-1H-1,5-naphthyridine-3-carboxamide;hydrochloride
CID 10112640
2-bromo-N-[(4-chlorophenyl)methyl]-8-oxo-5H-pyrido[3,2-d]pyrimidine-7-carboxamide
CID 22722030
N-[(4-ethoxyphenyl)methyl]-4-oxo-6-pyrrolidin-1-yl-1H-1,5-naphthyridine-3-carboxamide
CID 10271820
6-benzyl-N-(2-(18F)fluoroethyl)-4-oxo-1H-quinoline-3-carboxamide
CID 25210565
4-oxo-6-pyrrolidin-1-yl-N-(thiophen-2-ylmethyl)-1H-1,5-naphthyridine-3-carboxamide
CID 10108809
N-benzyl-3-methyl-2,4-dioxo-1H-pyrimidine-5-carboxamide
CID 121025213
N-benzyl-4-oxo-1H-pyridine-3-carboxamide
CID 23633090
5-[(4-fluorophenyl)methylcarbamoyl]-4-oxo-3-phenylmethoxy-1H-pyridine-2-carboxylic acid
CID 59600570
7-chloro-4-oxo-N-(pyridin-4-ylmethyl)-1H-quinoline-3-carboxamide
CID 39042088
methyl 2-benzyl-5H-pyrrolo[2,3-b]pyrazine-7-carboxylate
CID 141364909

Frequently Asked Questions

What is the IUPAC name of N,6-dibenzyl-4-oxo-1H-1,5-naphthyridine-3-carboxamide?
The IUPAC name of N,6-dibenzyl-4-oxo-1H-1,5-naphthyridine-3-carboxamide (CID 10109646) is N,6-dibenzyl-4-oxo-1H-1,5-naphthyridine-3-carboxamide.
What is the SMILES notation for N,6-dibenzyl-4-oxo-1H-1,5-naphthyridine-3-carboxamide?
The canonical SMILES for N,6-dibenzyl-4-oxo-1H-1,5-naphthyridine-3-carboxamide is O=C(NCc1ccccc1)c1c[nH]c2ccc(Cc3ccccc3)nc2c1=O.
What is the InChIKey of N,6-dibenzyl-4-oxo-1H-1,5-naphthyridine-3-carboxamide?
The InChIKey is MIKYRWDOCJFBST-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O2/c27-22-19(23(28)25-14-17-9-5-2-6-10-17)15-24-20-12-11-18(26-21(20)22)13-16-7-3-1-4-8-16/h1-12,15H,13-14H2,(H,24,27)(H,25,28).
What are the key properties of N,6-dibenzyl-4-oxo-1H-1,5-naphthyridine-3-carboxamide?
N,6-dibenzyl-4-oxo-1H-1,5-naphthyridine-3-carboxamide has a molecular weight of 369.42 g/mol, XLogP of 3.44, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dibenzyl-4-oxo-1H-1,5-naphthyridine-3-carboxamide is sourced from PubChem (CID 10109646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).