N-(1-cyclopropylethyl)-4-(ethylamino)-3-(trifluoromethyl)benzamide

C15H19F3N2O — CID 62168331

IUPACN-(1-cyclopropylethyl)-4-(ethylamino)-3-(trifluoromethyl)benzamide
SMILESCCNc1ccc(C(=O)NC(C)C2CC2)cc1C(F)(F)F
InChIInChI=1S/C15H19F3N2O/c1-3-19-13-7-6-11(8-12(13)15(16,17)18)14(21)20-9(2)10-4-5-10/h6-10,19H,3-5H2,1-2H3,(H,20,21)
InChIKeyOGQLHKLOBHMQRR-UHFFFAOYSA-N
MW300.32 g/mol
LogP3.67
Rot. Bonds5

About N-(1-cyclopropylethyl)-4-(ethylamino)-3-(trifluoromethyl)benzamide

N-(1-cyclopropylethyl)-4-(ethylamino)-3-(trifluoromethyl)benzamide (PubChem CID 62168331) has the molecular formula C15H19F3N2O and a molecular weight of 300.32 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-4-(ethylamino)-3-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-4-(ethylamino)-3-(trifluoromethyl)benzamide
PubChem CID62168331
Molecular FormulaC15H19F3N2O
Molecular Weight300.32 g/mol
Exact Mass300.14
IUPAC NameN-(1-cyclopropylethyl)-4-(ethylamino)-3-(trifluoromethyl)benzamide
SMILESCCNc1ccc(C(=O)NC(C)C2CC2)cc1C(F)(F)F
InChIInChI=1S/C15H19F3N2O/c1-3-19-13-7-6-11(8-12(13)15(16,17)18)14(21)20-9(2)10-4-5-10/h6-10,19H,3-5H2,1-2H3,(H,20,21)
InChIKeyOGQLHKLOBHMQRR-UHFFFAOYSA-N
XLogP3.67
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.32
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(1-cyclopropylethyl)-4-(ethylamino)-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

4-(ethylamino)-N-(2-methylcyclopropyl)-3-(trifluoromethyl)benzamide
CID 62409438
4-(ethylamino)-N-propyl-3-(trifluoromethyl)benzamide
CID 62171618
N-cyclopropyl-4-(ethylamino)-N-methyl-3-(trifluoromethyl)benzamide
CID 62167915
4-(ethylamino)-N-pentyl-3-(trifluoromethyl)benzamide
CID 62186743
N-(1-cyclopropylethyl)-3-methyl-4-(methylamino)benzamide
CID 63210093
4-(ethylamino)-N-(1,3,4-thiadiazol-2-yl)-3-(trifluoromethyl)benzamide
CID 62186065
N-methyl-4-(propylamino)-3-(trifluoromethyl)benzamide
CID 55042364
3-amino-N-(1-cyclopropylethyl)-4-(trifluoromethoxy)benzamide
CID 116628580
5-(1-cyclopropylethylcarbamoyl)-2-fluorobenzenesulfonyl chloride
CID 65373055
4-hydrazinyl-N-(4-methylpentan-2-yl)-3-(trifluoromethyl)benzamide
CID 62241747
3-chloro-N-(1-cyclopropylethyl)-4-hydroxybenzamide
CID 42919481
3-amino-N-(1-cyclopropylethyl)-4-methylbenzamide
CID 43533090

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-4-(ethylamino)-3-(trifluoromethyl)benzamide?
The IUPAC name of N-(1-cyclopropylethyl)-4-(ethylamino)-3-(trifluoromethyl)benzamide (CID 62168331) is N-(1-cyclopropylethyl)-4-(ethylamino)-3-(trifluoromethyl)benzamide.
What is the SMILES notation for N-(1-cyclopropylethyl)-4-(ethylamino)-3-(trifluoromethyl)benzamide?
The canonical SMILES for N-(1-cyclopropylethyl)-4-(ethylamino)-3-(trifluoromethyl)benzamide is CCNc1ccc(C(=O)NC(C)C2CC2)cc1C(F)(F)F.
What is the InChIKey of N-(1-cyclopropylethyl)-4-(ethylamino)-3-(trifluoromethyl)benzamide?
The InChIKey is OGQLHKLOBHMQRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F3N2O/c1-3-19-13-7-6-11(8-12(13)15(16,17)18)14(21)20-9(2)10-4-5-10/h6-10,19H,3-5H2,1-2H3,(H,20,21).
What are the key properties of N-(1-cyclopropylethyl)-4-(ethylamino)-3-(trifluoromethyl)benzamide?
N-(1-cyclopropylethyl)-4-(ethylamino)-3-(trifluoromethyl)benzamide has a molecular weight of 300.32 g/mol, XLogP of 3.67, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-4-(ethylamino)-3-(trifluoromethyl)benzamide is sourced from PubChem (CID 62168331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).