1-ethyl-2-oxo-N-[2-(trifluoromethyl)phenyl]-1,8-naphthyridine-3-carboxamide

C18H14F3N3O2 — CID 7619878

IUPAC1-ethyl-2-oxo-N-[2-(trifluoromethyl)phenyl]-1,8-naphthyridine-3-carboxamide
SMILESCCn1c(=O)c(C(=O)Nc2ccccc2C(F)(F)F)cc2cccnc21
InChIInChI=1S/C18H14F3N3O2/c1-2-24-15-11(6-5-9-22-15)10-12(17(24)26)16(25)23-14-8-4-3-7-13(14)18(19,20)21/h3-10H,2H2,1H3,(H,23,25)
InChIKeyFAFRMQDMAMMTSQ-UHFFFAOYSA-N
MW361.32 g/mol
LogP3.69
Rot. Bonds3

About 1-ethyl-2-oxo-N-[2-(trifluoromethyl)phenyl]-1,8-naphthyridine-3-carboxamide

1-ethyl-2-oxo-N-[2-(trifluoromethyl)phenyl]-1,8-naphthyridine-3-carboxamide (PubChem CID 7619878) has the molecular formula C18H14F3N3O2 and a molecular weight of 361.32 g/mol. Its IUPAC name is 1-ethyl-2-oxo-N-[2-(trifluoromethyl)phenyl]-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name1-ethyl-2-oxo-N-[2-(trifluoromethyl)phenyl]-1,8-naphthyridine-3-carboxamide
PubChem CID7619878
Molecular FormulaC18H14F3N3O2
Molecular Weight361.32 g/mol
Exact Mass361.10
IUPAC Name1-ethyl-2-oxo-N-[2-(trifluoromethyl)phenyl]-1,8-naphthyridine-3-carboxamide
SMILESCCn1c(=O)c(C(=O)Nc2ccccc2C(F)(F)F)cc2cccnc21
InChIInChI=1S/C18H14F3N3O2/c1-2-24-15-11(6-5-9-22-15)10-12(17(24)26)16(25)23-14-8-4-3-7-13(14)18(19,20)21/h3-10H,2H2,1H3,(H,23,25)
InChIKeyFAFRMQDMAMMTSQ-UHFFFAOYSA-N
XLogP3.69
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.32
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(1-ethyl-2-oxo-1,8-naphthyridine-3-carbonyl)amino]benzenethiolate
CID 135782783
N-(3,5-dimethylphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619925
1-ethyl-N-(3-fluoro-4-methylphenyl)-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619936
N-(2,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619927
N-(3-acetylphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619897
N-(3,3-diphenylpropyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619829
N-(2-ethylphenyl)-1-[(4-methylphenyl)methyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7620518
1-ethyl-N-[(4-methylphenyl)methyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619808
N-(3,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619926
1-ethyl-2-oxo-N-[(2R)-4-phenylbutan-2-yl]-1,8-naphthyridine-3-carboxamide
CID 7619828
1-benzyl-N-(2-fluorophenyl)-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7620230
1-ethyl-2-oxo-N-(7H-purin-6-yl)-1,8-naphthyridine-3-carboxamide
CID 7620011

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-oxo-N-[2-(trifluoromethyl)phenyl]-1,8-naphthyridine-3-carboxamide?
The IUPAC name of 1-ethyl-2-oxo-N-[2-(trifluoromethyl)phenyl]-1,8-naphthyridine-3-carboxamide (CID 7619878) is 1-ethyl-2-oxo-N-[2-(trifluoromethyl)phenyl]-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for 1-ethyl-2-oxo-N-[2-(trifluoromethyl)phenyl]-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for 1-ethyl-2-oxo-N-[2-(trifluoromethyl)phenyl]-1,8-naphthyridine-3-carboxamide is CCn1c(=O)c(C(=O)Nc2ccccc2C(F)(F)F)cc2cccnc21.
What is the InChIKey of 1-ethyl-2-oxo-N-[2-(trifluoromethyl)phenyl]-1,8-naphthyridine-3-carboxamide?
The InChIKey is FAFRMQDMAMMTSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14F3N3O2/c1-2-24-15-11(6-5-9-22-15)10-12(17(24)26)16(25)23-14-8-4-3-7-13(14)18(19,20)21/h3-10H,2H2,1H3,(H,23,25).
What are the key properties of 1-ethyl-2-oxo-N-[2-(trifluoromethyl)phenyl]-1,8-naphthyridine-3-carboxamide?
1-ethyl-2-oxo-N-[2-(trifluoromethyl)phenyl]-1,8-naphthyridine-3-carboxamide has a molecular weight of 361.32 g/mol, XLogP of 3.69, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-oxo-N-[2-(trifluoromethyl)phenyl]-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 7619878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).