N-cyclopropyl-4-propan-2-yl-3-(trifluoromethyl)benzamide

C14H16F3NO — CID 70841150

IUPACN-cyclopropyl-4-propan-2-yl-3-(trifluoromethyl)benzamide
SMILESCC(C)c1ccc(C(=O)NC2CC2)cc1C(F)(F)F
InChIInChI=1S/C14H16F3NO/c1-8(2)11-6-3-9(7-12(11)14(15,16)17)13(19)18-10-4-5-10/h3,6-8,10H,4-5H2,1-2H3,(H,18,19)
InChIKeyVAWDKLAKIMOHAA-UHFFFAOYSA-N
MW271.28 g/mol
LogP3.72
Rot. Bonds3

About N-cyclopropyl-4-propan-2-yl-3-(trifluoromethyl)benzamide

N-cyclopropyl-4-propan-2-yl-3-(trifluoromethyl)benzamide (PubChem CID 70841150) has the molecular formula C14H16F3NO and a molecular weight of 271.28 g/mol. Its IUPAC name is N-cyclopropyl-4-propan-2-yl-3-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-cyclopropyl-4-propan-2-yl-3-(trifluoromethyl)benzamide
PubChem CID70841150
Molecular FormulaC14H16F3NO
Molecular Weight271.28 g/mol
Exact Mass271.12
IUPAC NameN-cyclopropyl-4-propan-2-yl-3-(trifluoromethyl)benzamide
SMILESCC(C)c1ccc(C(=O)NC2CC2)cc1C(F)(F)F
InChIInChI=1S/C14H16F3NO/c1-8(2)11-6-3-9(7-12(11)14(15,16)17)13(19)18-10-4-5-10/h3,6-8,10H,4-5H2,1-2H3,(H,18,19)
InChIKeyVAWDKLAKIMOHAA-UHFFFAOYSA-N
XLogP3.72
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.28
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-cyclopropyl-4-propan-2-yl-3-(trifluoromethyl)benzamide 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-cyclopentyl-4-methyl-3-(trifluoromethyl)benzamide;ethane
CID 143518769
4-amino-N-(4-methylcyclohexyl)-3-(trifluoromethyl)benzamide
CID 62153973
4-bromo-N-(4-bromocyclohexyl)-3-(trifluoromethyl)benzamide
CID 114309058
3-amino-N-cyclobutyl-4-(trifluoromethyl)benzamide
CID 146047094
N-cyclobutyl-3-methyl-4-propan-2-ylbenzamide;molecular hydrogen
CID 159338969
4-amino-N-(3-methylcyclopentyl)-3-(trifluoromethyl)benzamide
CID 114540505
4-propan-2-yl-N-[4-[(4-propan-2-ylbenzoyl)amino]cyclohexyl]benzamide
CID 1001424
3-bromo-N-(4,4-difluorocyclohexyl)-4-(trifluoromethyl)benzamide
CID 176508179
4-(1-bromoethyl)-3-(trifluoromethyl)benzoic acid
CID 174517162
4-amino-N-(oxan-3-yl)-3-(trifluoromethyl)benzamide
CID 63362160
4-fluoro-N-(2-methyloxan-4-yl)-3-(trifluoromethyl)benzamide
CID 103888185
3-bromo-N-(oxolan-3-yl)-4-(trifluoromethyl)benzamide
CID 176508175

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-propan-2-yl-3-(trifluoromethyl)benzamide?
The IUPAC name of N-cyclopropyl-4-propan-2-yl-3-(trifluoromethyl)benzamide (CID 70841150) is N-cyclopropyl-4-propan-2-yl-3-(trifluoromethyl)benzamide.
What is the SMILES notation for N-cyclopropyl-4-propan-2-yl-3-(trifluoromethyl)benzamide?
The canonical SMILES for N-cyclopropyl-4-propan-2-yl-3-(trifluoromethyl)benzamide is CC(C)c1ccc(C(=O)NC2CC2)cc1C(F)(F)F.
What is the InChIKey of N-cyclopropyl-4-propan-2-yl-3-(trifluoromethyl)benzamide?
The InChIKey is VAWDKLAKIMOHAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16F3NO/c1-8(2)11-6-3-9(7-12(11)14(15,16)17)13(19)18-10-4-5-10/h3,6-8,10H,4-5H2,1-2H3,(H,18,19).
What are the key properties of N-cyclopropyl-4-propan-2-yl-3-(trifluoromethyl)benzamide?
N-cyclopropyl-4-propan-2-yl-3-(trifluoromethyl)benzamide has a molecular weight of 271.28 g/mol, XLogP of 3.72, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-propan-2-yl-3-(trifluoromethyl)benzamide is sourced from PubChem (CID 70841150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).