N-butyl-N-cyclopropyl-2-(propylamino)benzamide

C17H26N2O — CID 62179116

IUPACN-butyl-N-cyclopropyl-2-(propylamino)benzamide
SMILESCCCCN(C(=O)c1ccccc1NCCC)C1CC1
InChIInChI=1S/C17H26N2O/c1-3-5-13-19(14-10-11-14)17(20)15-8-6-7-9-16(15)18-12-4-2/h6-9,14,18H,3-5,10-13H2,1-2H3
InChIKeyACBIVSNVQSYXCZ-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.91
Rot. Bonds8

About N-butyl-N-cyclopropyl-2-(propylamino)benzamide

N-butyl-N-cyclopropyl-2-(propylamino)benzamide (PubChem CID 62179116) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-butyl-N-cyclopropyl-2-(propylamino)benzamide.

Molecular Properties

Compound NameN-butyl-N-cyclopropyl-2-(propylamino)benzamide
PubChem CID62179116
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-butyl-N-cyclopropyl-2-(propylamino)benzamide
SMILESCCCCN(C(=O)c1ccccc1NCCC)C1CC1
InChIInChI=1S/C17H26N2O/c1-3-5-13-19(14-10-11-14)17(20)15-8-6-7-9-16(15)18-12-4-2/h6-9,14,18H,3-5,10-13H2,1-2H3
InChIKeyACBIVSNVQSYXCZ-UHFFFAOYSA-N
XLogP3.91
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-butyl-N-cyclopropyl-2-(propylamino)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-cyclopropyl-N-methyl-2-(propylamino)benzamide
CID 62169629
N-butyl-N-cyclopropyl-2,3-difluorobenzamide
CID 55210520
N,N-diethyl-2-(propylamino)benzamide
CID 62171276
N-pentyl-N-propan-2-yl-2-(propylamino)benzamide
CID 62174124
N-butyl-N-cyclopropyl-4-(ethylamino)pyridine-3-carboxamide
CID 81242322
N-methyl-N-(2-methylcyclohexyl)-2-(propylamino)benzamide
CID 62175214
3-amino-N-butyl-N-cyclopropyl-2-hydroxybenzamide
CID 113386417
N-(2-hydroxypropyl)-N-methyl-2-(propylamino)benzamide
CID 55061041
N-butyl-N-cyclopropyl-3-hydrazinylpyridine-4-carboxamide
CID 105071708
N-methyl-N-propan-2-yl-2-(propylamino)benzamide
CID 62166178
N-(2-cyclopropyl-2-hydroxyethyl)-2-(propylamino)benzamide
CID 63297170
N-cyclopropyl-N-propyl-2-sulfanylbenzamide
CID 107022431

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-cyclopropyl-2-(propylamino)benzamide?
The IUPAC name of N-butyl-N-cyclopropyl-2-(propylamino)benzamide (CID 62179116) is N-butyl-N-cyclopropyl-2-(propylamino)benzamide.
What is the SMILES notation for N-butyl-N-cyclopropyl-2-(propylamino)benzamide?
The canonical SMILES for N-butyl-N-cyclopropyl-2-(propylamino)benzamide is CCCCN(C(=O)c1ccccc1NCCC)C1CC1.
What is the InChIKey of N-butyl-N-cyclopropyl-2-(propylamino)benzamide?
The InChIKey is ACBIVSNVQSYXCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-3-5-13-19(14-10-11-14)17(20)15-8-6-7-9-16(15)18-12-4-2/h6-9,14,18H,3-5,10-13H2,1-2H3.
What are the key properties of N-butyl-N-cyclopropyl-2-(propylamino)benzamide?
N-butyl-N-cyclopropyl-2-(propylamino)benzamide has a molecular weight of 274.41 g/mol, XLogP of 3.91, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-cyclopropyl-2-(propylamino)benzamide is sourced from PubChem (CID 62179116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).