N-(cyclohexylcarbamoyl)-4-methoxy-2-(trifluoromethyl)benzamide

C16H19F3N2O3 — CID 143825373

IUPACN-(cyclohexylcarbamoyl)-4-methoxy-2-(trifluoromethyl)benzamide
SMILESCOc1ccc(C(=O)NC(=O)NC2CCCCC2)c(C(F)(F)F)c1
InChIInChI=1S/C16H19F3N2O3/c1-24-11-7-8-12(13(9-11)16(17,18)19)14(22)21-15(23)20-10-5-3-2-4-6-10/h7-10H,2-6H2,1H3,(H2,20,21,22,23)
InChIKeyLUXXICOMVYRMSO-UHFFFAOYSA-N
MW344.33 g/mol
LogP3.49
Rot. Bonds3

About N-(cyclohexylcarbamoyl)-4-methoxy-2-(trifluoromethyl)benzamide

N-(cyclohexylcarbamoyl)-4-methoxy-2-(trifluoromethyl)benzamide (PubChem CID 143825373) has the molecular formula C16H19F3N2O3 and a molecular weight of 344.33 g/mol. Its IUPAC name is N-(cyclohexylcarbamoyl)-4-methoxy-2-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-(cyclohexylcarbamoyl)-4-methoxy-2-(trifluoromethyl)benzamide
PubChem CID143825373
Molecular FormulaC16H19F3N2O3
Molecular Weight344.33 g/mol
Exact Mass344.13
IUPAC NameN-(cyclohexylcarbamoyl)-4-methoxy-2-(trifluoromethyl)benzamide
SMILESCOc1ccc(C(=O)NC(=O)NC2CCCCC2)c(C(F)(F)F)c1
InChIInChI=1S/C16H19F3N2O3/c1-24-11-7-8-12(13(9-11)16(17,18)19)14(22)21-15(23)20-10-5-3-2-4-6-10/h7-10H,2-6H2,1H3,(H2,20,21,22,23)
InChIKeyLUXXICOMVYRMSO-UHFFFAOYSA-N
XLogP3.49
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.33
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[cyclohexyl(methyl)carbamoyl]-4-methoxy-2-(trifluoromethyl)benzamide
CID 143825461
N-cyclohexyl-2,5-dimethoxybenzamide
CID 8573659
N-cyclopentyl-4-iodo-2-(trifluoromethyl)benzamide
CID 171921545
1-cycloheptyl-3-(2,5-dimethoxyphenyl)urea
CID 6470715
N-cyclopropyl-2,4-dimethoxybenzamide
CID 4576292
N-cyclohexyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzamide
CID 167713480
1-cycloheptyl-3-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)urea
CID 22580903
1-[4-methoxy-2-(trifluoromethyl)phenyl]prop-2-en-1-one
CID 130319279
4-[[4-methoxy-2-(trifluoromethyl)phenyl]methylcarbamoylamino]-N-methylcyclohexane-1-carboxamide
CID 167837881
N-cycloheptyl-2-(2,5-dimethoxyphenyl)acetamide
CID 7580886
N-cycloheptyl-2,5-bis(trifluoromethyl)benzamide
CID 154183333
1-cyclohexyl-3-[(4-methoxyphenyl)methyl]urea
CID 854988

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylcarbamoyl)-4-methoxy-2-(trifluoromethyl)benzamide?
The IUPAC name of N-(cyclohexylcarbamoyl)-4-methoxy-2-(trifluoromethyl)benzamide (CID 143825373) is N-(cyclohexylcarbamoyl)-4-methoxy-2-(trifluoromethyl)benzamide.
What is the SMILES notation for N-(cyclohexylcarbamoyl)-4-methoxy-2-(trifluoromethyl)benzamide?
The canonical SMILES for N-(cyclohexylcarbamoyl)-4-methoxy-2-(trifluoromethyl)benzamide is COc1ccc(C(=O)NC(=O)NC2CCCCC2)c(C(F)(F)F)c1.
What is the InChIKey of N-(cyclohexylcarbamoyl)-4-methoxy-2-(trifluoromethyl)benzamide?
The InChIKey is LUXXICOMVYRMSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19F3N2O3/c1-24-11-7-8-12(13(9-11)16(17,18)19)14(22)21-15(23)20-10-5-3-2-4-6-10/h7-10H,2-6H2,1H3,(H2,20,21,22,23).
What are the key properties of N-(cyclohexylcarbamoyl)-4-methoxy-2-(trifluoromethyl)benzamide?
N-(cyclohexylcarbamoyl)-4-methoxy-2-(trifluoromethyl)benzamide has a molecular weight of 344.33 g/mol, XLogP of 3.49, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylcarbamoyl)-4-methoxy-2-(trifluoromethyl)benzamide is sourced from PubChem (CID 143825373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).