N-[5-methyl-7-(trifluoromethyl)-1,8-naphthyridin-2-yl]cyclohexanecarboxamide

C17H18F3N3O — CID 16667917

IUPACN-[5-methyl-7-(trifluoromethyl)-1,8-naphthyridin-2-yl]cyclohexanecarboxamide
SMILESCc1cc(C(F)(F)F)nc2nc(NC(=O)C3CCCCC3)ccc12
InChIInChI=1S/C17H18F3N3O/c1-10-9-13(17(18,19)20)21-15-12(10)7-8-14(22-15)23-16(24)11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3,(H,21,22,23,24)
InChIKeyNXHCNMMRKPWODP-UHFFFAOYSA-N
MW337.35 g/mol
LogP4.48
Rot. Bonds2

About N-[5-methyl-7-(trifluoromethyl)-1,8-naphthyridin-2-yl]cyclohexanecarboxamide

N-[5-methyl-7-(trifluoromethyl)-1,8-naphthyridin-2-yl]cyclohexanecarboxamide (PubChem CID 16667917) has the molecular formula C17H18F3N3O and a molecular weight of 337.35 g/mol. Its IUPAC name is N-[5-methyl-7-(trifluoromethyl)-1,8-naphthyridin-2-yl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[5-methyl-7-(trifluoromethyl)-1,8-naphthyridin-2-yl]cyclohexanecarboxamide
PubChem CID16667917
Molecular FormulaC17H18F3N3O
Molecular Weight337.35 g/mol
Exact Mass337.14
IUPAC NameN-[5-methyl-7-(trifluoromethyl)-1,8-naphthyridin-2-yl]cyclohexanecarboxamide
SMILESCc1cc(C(F)(F)F)nc2nc(NC(=O)C3CCCCC3)ccc12
InChIInChI=1S/C17H18F3N3O/c1-10-9-13(17(18,19)20)21-15-12(10)7-8-14(22-15)23-16(24)11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3,(H,21,22,23,24)
InChIKeyNXHCNMMRKPWODP-UHFFFAOYSA-N
XLogP4.48
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.35
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[5-methyl-7-(trifluoromethyl)-1,8-naphthyridin-2-yl]cyclohexanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[6-(cyclohexanecarbonylamino)-2-pyridinyl]cyclohexanecarboxamide
CID 5223932
N-(5-iodo-6-methyl-2-pyridinyl)cyclobutanecarboxamide
CID 119042245
2-(cyclobutanecarbonylamino)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 66611880
N-(6-chloro-5-methyl-2-pyridinyl)cyclopropanecarboxamide
CID 87276605
N-(7-formyl-5-methyl-1,8-naphthyridin-2-yl)acetamide
CID 121016050
N-(5,7-dimethyl-1,8-naphthyridin-2-yl)butanamide
CID 6488581
N-quinolin-2-ylcyclopentanecarboxamide
CID 39959364
N-(5-methyl-1H-pyrazol-3-yl)cyclooctanecarboxamide
CID 65022914
7-(cyclobutanecarbonylamino)-2-methylquinoline-5-carboxylic acid
CID 90488075
N-[7-(2,2-dimethylpropyl)quinolin-2-yl]cyclobutanecarboxamide
CID 155185001
N-[3-(trifluoromethyl)phenyl]cyclohexanecarboxamide
CID 874898
4-(cyclooctanecarbonylamino)-2-methylbenzoic acid
CID 65019247

Frequently Asked Questions

What is the IUPAC name of N-[5-methyl-7-(trifluoromethyl)-1,8-naphthyridin-2-yl]cyclohexanecarboxamide?
The IUPAC name of N-[5-methyl-7-(trifluoromethyl)-1,8-naphthyridin-2-yl]cyclohexanecarboxamide (CID 16667917) is N-[5-methyl-7-(trifluoromethyl)-1,8-naphthyridin-2-yl]cyclohexanecarboxamide.
What is the SMILES notation for N-[5-methyl-7-(trifluoromethyl)-1,8-naphthyridin-2-yl]cyclohexanecarboxamide?
The canonical SMILES for N-[5-methyl-7-(trifluoromethyl)-1,8-naphthyridin-2-yl]cyclohexanecarboxamide is Cc1cc(C(F)(F)F)nc2nc(NC(=O)C3CCCCC3)ccc12.
What is the InChIKey of N-[5-methyl-7-(trifluoromethyl)-1,8-naphthyridin-2-yl]cyclohexanecarboxamide?
The InChIKey is NXHCNMMRKPWODP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18F3N3O/c1-10-9-13(17(18,19)20)21-15-12(10)7-8-14(22-15)23-16(24)11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3,(H,21,22,23,24).
What are the key properties of N-[5-methyl-7-(trifluoromethyl)-1,8-naphthyridin-2-yl]cyclohexanecarboxamide?
N-[5-methyl-7-(trifluoromethyl)-1,8-naphthyridin-2-yl]cyclohexanecarboxamide has a molecular weight of 337.35 g/mol, XLogP of 4.48, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-methyl-7-(trifluoromethyl)-1,8-naphthyridin-2-yl]cyclohexanecarboxamide is sourced from PubChem (CID 16667917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).