1-benzyl-2-oxo-N-[(2R)-4-phenylbutan-2-yl]-1,8-naphthyridine-3-carboxamide

C26H25N3O2 — CID 7620195

IUPAC1-benzyl-2-oxo-N-[(2R)-4-phenylbutan-2-yl]-1,8-naphthyridine-3-carboxamide
SMILESC[C@H](CCc1ccccc1)NC(=O)c1cc2cccnc2n(Cc2ccccc2)c1=O
InChIInChI=1S/C26H25N3O2/c1-19(14-15-20-9-4-2-5-10-20)28-25(30)23-17-22-13-8-16-27-24(22)29(26(23)31)18-21-11-6-3-7-12-21/h2-13,16-17,19H,14-15,18H2,1H3,(H,28,30)/t19-/m1/s1
InChIKeyQFPVVXQTZJFWJS-LJQANCHMSA-N
MW411.50 g/mol
LogP4.20
Rot. Bonds7

About 1-benzyl-2-oxo-N-[(2R)-4-phenylbutan-2-yl]-1,8-naphthyridine-3-carboxamide

1-benzyl-2-oxo-N-[(2R)-4-phenylbutan-2-yl]-1,8-naphthyridine-3-carboxamide (PubChem CID 7620195) has the molecular formula C26H25N3O2 and a molecular weight of 411.50 g/mol. Its IUPAC name is 1-benzyl-2-oxo-N-[(2R)-4-phenylbutan-2-yl]-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name1-benzyl-2-oxo-N-[(2R)-4-phenylbutan-2-yl]-1,8-naphthyridine-3-carboxamide
PubChem CID7620195
Molecular FormulaC26H25N3O2
Molecular Weight411.50 g/mol
Exact Mass411.19
IUPAC Name1-benzyl-2-oxo-N-[(2R)-4-phenylbutan-2-yl]-1,8-naphthyridine-3-carboxamide
SMILESC[C@H](CCc1ccccc1)NC(=O)c1cc2cccnc2n(Cc2ccccc2)c1=O
InChIInChI=1S/C26H25N3O2/c1-19(14-15-20-9-4-2-5-10-20)28-25(30)23-17-22-13-8-16-27-24(22)29(26(23)31)18-21-11-6-3-7-12-21/h2-13,16-17,19H,14-15,18H2,1H3,(H,28,30)/t19-/m1/s1
InChIKeyQFPVVXQTZJFWJS-LJQANCHMSA-N
XLogP4.20
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.50
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-ethyl-2-oxo-N-[(2R)-4-phenylbutan-2-yl]-1,8-naphthyridine-3-carboxamide
CID 7619828
1-benzyl-N-[(2S)-1-methoxypropan-2-yl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7620106
1-methyl-2-oxo-N-(4-phenylbutan-2-yl)-1,8-naphthyridine-3-carboxamide
CID 43995808
[(4S)-4-[(1-benzyl-2-oxo-1,8-naphthyridine-3-carbonyl)amino]pentyl]-diethylazanium
CID 7620129
N-butan-2-yl-1-[(4-chlorophenyl)methyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 43996260
1-benzyl-2-oxo-N-propyl-1,8-naphthyridine-3-carboxamide
CID 7620085
1-[(4-methylphenyl)methyl]-2-oxo-N-(3-phenylpropyl)-1,8-naphthyridine-3-carboxamide
CID 7620499
N-[(2R)-5-(diethylamino)pentan-2-yl]-1-[(4-fluorophenyl)methyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 26844200
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-benzyl-N-(2-fluorophenyl)-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7620230
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 1-benzyl-2-oxo-N-[(2R)-4-phenylbutan-2-yl]-1,8-naphthyridine-3-carboxamide?
The IUPAC name of 1-benzyl-2-oxo-N-[(2R)-4-phenylbutan-2-yl]-1,8-naphthyridine-3-carboxamide (CID 7620195) is 1-benzyl-2-oxo-N-[(2R)-4-phenylbutan-2-yl]-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for 1-benzyl-2-oxo-N-[(2R)-4-phenylbutan-2-yl]-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for 1-benzyl-2-oxo-N-[(2R)-4-phenylbutan-2-yl]-1,8-naphthyridine-3-carboxamide is C[C@H](CCc1ccccc1)NC(=O)c1cc2cccnc2n(Cc2ccccc2)c1=O.
What is the InChIKey of 1-benzyl-2-oxo-N-[(2R)-4-phenylbutan-2-yl]-1,8-naphthyridine-3-carboxamide?
The InChIKey is QFPVVXQTZJFWJS-LJQANCHMSA-N. The full InChI is InChI=1S/C26H25N3O2/c1-19(14-15-20-9-4-2-5-10-20)28-25(30)23-17-22-13-8-16-27-24(22)29(26(23)31)18-21-11-6-3-7-12-21/h2-13,16-17,19H,14-15,18H2,1H3,(H,28,30)/t19-/m1/s1.
What are the key properties of 1-benzyl-2-oxo-N-[(2R)-4-phenylbutan-2-yl]-1,8-naphthyridine-3-carboxamide?
1-benzyl-2-oxo-N-[(2R)-4-phenylbutan-2-yl]-1,8-naphthyridine-3-carboxamide has a molecular weight of 411.50 g/mol, XLogP of 4.20, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-2-oxo-N-[(2R)-4-phenylbutan-2-yl]-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 7620195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).