N-(3,3-diphenylpropyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide

C26H25N3O2 — CID 7619829

IUPACN-(3,3-diphenylpropyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide
SMILESCCn1c(=O)c(C(=O)NCCC(c2ccccc2)c2ccccc2)cc2cccnc21
InChIInChI=1S/C26H25N3O2/c1-2-29-24-21(14-9-16-27-24)18-23(26(29)31)25(30)28-17-15-22(19-10-5-3-6-11-19)20-12-7-4-8-13-20/h3-14,16,18,22H,2,15,17H2,1H3,(H,28,30)
InChIKeyRTFJOMHEIXOYQY-UHFFFAOYSA-N
MW411.51 g/mol
LogP4.37
Rot. Bonds7

About N-(3,3-diphenylpropyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide

N-(3,3-diphenylpropyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide (PubChem CID 7619829) has the molecular formula C26H25N3O2 and a molecular weight of 411.51 g/mol. Its IUPAC name is N-(3,3-diphenylpropyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3,3-diphenylpropyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide
PubChem CID7619829
Molecular FormulaC26H25N3O2
Molecular Weight411.51 g/mol
Exact Mass411.19
IUPAC NameN-(3,3-diphenylpropyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide
SMILESCCn1c(=O)c(C(=O)NCCC(c2ccccc2)c2ccccc2)cc2cccnc21
InChIInChI=1S/C26H25N3O2/c1-2-29-24-21(14-9-16-27-24)18-23(26(29)31)25(30)28-17-15-22(19-10-5-3-6-11-19)20-12-7-4-8-13-20/h3-14,16,18,22H,2,15,17H2,1H3,(H,28,30)
InChIKeyRTFJOMHEIXOYQY-UHFFFAOYSA-N
XLogP4.37
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.51
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,3-diphenylpropyl)-1-[(4-fluorophenyl)methyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 26844208
1-benzyl-2-oxo-N-propyl-1,8-naphthyridine-3-carboxamide
CID 7620085
N-cyclopentyl-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619782
1-ethyl-2-oxo-N-[(2R)-4-phenylbutan-2-yl]-1,8-naphthyridine-3-carboxamide
CID 7619828
2-[(1-ethyl-2-oxo-1,8-naphthyridine-3-carbonyl)amino]benzenethiolate
CID 135782783
1-ethyl-N-[(4-methylphenyl)methyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619808
1-ethyl-2-oxo-N-[2-(trifluoromethyl)phenyl]-1,8-naphthyridine-3-carboxamide
CID 7619878
N-(3,5-dimethylphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619925
1-ethyl-N-[(1S,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619800
1-ethyl-N-(3-fluoro-4-methylphenyl)-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619936
1-benzyl-N-[3-(dimethylamino)propyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7620123
N-ethyl-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619354

Frequently Asked Questions

What is the IUPAC name of N-(3,3-diphenylpropyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide?
The IUPAC name of N-(3,3-diphenylpropyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide (CID 7619829) is N-(3,3-diphenylpropyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for N-(3,3-diphenylpropyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for N-(3,3-diphenylpropyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide is CCn1c(=O)c(C(=O)NCCC(c2ccccc2)c2ccccc2)cc2cccnc21.
What is the InChIKey of N-(3,3-diphenylpropyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide?
The InChIKey is RTFJOMHEIXOYQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N3O2/c1-2-29-24-21(14-9-16-27-24)18-23(26(29)31)25(30)28-17-15-22(19-10-5-3-6-11-19)20-12-7-4-8-13-20/h3-14,16,18,22H,2,15,17H2,1H3,(H,28,30).
What are the key properties of N-(3,3-diphenylpropyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide?
N-(3,3-diphenylpropyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide has a molecular weight of 411.51 g/mol, XLogP of 4.37, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-diphenylpropyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 7619829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).