1-benzyl-N,N-diethyl-2-oxo-1,8-naphthyridine-3-carboxamide

C20H21N3O2 — CID 7620018

IUPAC1-benzyl-N,N-diethyl-2-oxo-1,8-naphthyridine-3-carboxamide
SMILESCCN(CC)C(=O)c1cc2cccnc2n(Cc2ccccc2)c1=O
InChIInChI=1S/C20H21N3O2/c1-3-22(4-2)19(24)17-13-16-11-8-12-21-18(16)23(20(17)25)14-15-9-6-5-7-10-15/h5-13H,3-4,14H2,1-2H3
InChIKeyQQAJOBGNHXUAGX-UHFFFAOYSA-N
MW335.41 g/mol
LogP2.93
Rot. Bonds5

About 1-benzyl-N,N-diethyl-2-oxo-1,8-naphthyridine-3-carboxamide

1-benzyl-N,N-diethyl-2-oxo-1,8-naphthyridine-3-carboxamide (PubChem CID 7620018) has the molecular formula C20H21N3O2 and a molecular weight of 335.41 g/mol. Its IUPAC name is 1-benzyl-N,N-diethyl-2-oxo-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name1-benzyl-N,N-diethyl-2-oxo-1,8-naphthyridine-3-carboxamide
PubChem CID7620018
Molecular FormulaC20H21N3O2
Molecular Weight335.41 g/mol
Exact Mass335.16
IUPAC Name1-benzyl-N,N-diethyl-2-oxo-1,8-naphthyridine-3-carboxamide
SMILESCCN(CC)C(=O)c1cc2cccnc2n(Cc2ccccc2)c1=O
InChIInChI=1S/C20H21N3O2/c1-3-22(4-2)19(24)17-13-16-11-8-12-21-18(16)23(20(17)25)14-15-9-6-5-7-10-15/h5-13H,3-4,14H2,1-2H3
InChIKeyQQAJOBGNHXUAGX-UHFFFAOYSA-N
XLogP2.93
TPSA55.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-N-ethyl-1-[(4-fluorophenyl)methyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7620626
1-benzyl-2-oxo-N-propyl-1,8-naphthyridine-3-carboxamide
CID 7620085
N-benzyl-1-[(4-chlorophenyl)methyl]-2-oxo-N-(2-phenylethyl)-1,8-naphthyridine-3-carboxamide
CID 43996238
1-benzyl-N-[3-(dimethylamino)propyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7620123
N-benzyl-1-[(4-methylphenyl)methyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7620472
1-benzyl-2-oxo-N-(pyridin-2-ylmethyl)-1,8-naphthyridine-3-carboxamide
CID 7620181
1-[(4-methylphenyl)methyl]-2-oxo-N,N-di(propan-2-yl)-1,8-naphthyridine-3-carboxamide
CID 7620348
N-ethyl-N-(3-methylphenyl)-1-[(4-methylphenyl)methyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7620509
1-[(4-methylphenyl)methyl]-2-oxo-N-(3-phenylpropyl)-1,8-naphthyridine-3-carboxamide
CID 7620499
N-ethyl-1-[(2-fluorophenyl)methyl]-2-oxo-N-phenyl-1,8-naphthyridine-3-carboxamide
CID 43996164
N-cyclohexyl-N-ethyl-1-[(4-methylphenyl)methyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7620356
1-benzyl-2-oxo-N-[(2R)-4-phenylbutan-2-yl]-1,8-naphthyridine-3-carboxamide
CID 7620195

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N,N-diethyl-2-oxo-1,8-naphthyridine-3-carboxamide?
The IUPAC name of 1-benzyl-N,N-diethyl-2-oxo-1,8-naphthyridine-3-carboxamide (CID 7620018) is 1-benzyl-N,N-diethyl-2-oxo-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for 1-benzyl-N,N-diethyl-2-oxo-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for 1-benzyl-N,N-diethyl-2-oxo-1,8-naphthyridine-3-carboxamide is CCN(CC)C(=O)c1cc2cccnc2n(Cc2ccccc2)c1=O.
What is the InChIKey of 1-benzyl-N,N-diethyl-2-oxo-1,8-naphthyridine-3-carboxamide?
The InChIKey is QQAJOBGNHXUAGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O2/c1-3-22(4-2)19(24)17-13-16-11-8-12-21-18(16)23(20(17)25)14-15-9-6-5-7-10-15/h5-13H,3-4,14H2,1-2H3.
What are the key properties of 1-benzyl-N,N-diethyl-2-oxo-1,8-naphthyridine-3-carboxamide?
1-benzyl-N,N-diethyl-2-oxo-1,8-naphthyridine-3-carboxamide has a molecular weight of 335.41 g/mol, XLogP of 2.93, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N,N-diethyl-2-oxo-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 7620018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).