2-[1-(3-chlorophenyl)propylamino]-N-cyclopropylpropanamide

C15H21ClN2O — CID 112551799

IUPAC2-[1-(3-chlorophenyl)propylamino]-N-cyclopropylpropanamide
SMILESCCC(NC(C)C(=O)NC1CC1)c1cccc(Cl)c1
InChIInChI=1S/C15H21ClN2O/c1-3-14(11-5-4-6-12(16)9-11)17-10(2)15(19)18-13-7-8-13/h4-6,9-10,13-14,17H,3,7-8H2,1-2H3,(H,18,19)
InChIKeyUKAIWVCRRPLEAS-UHFFFAOYSA-N
MW280.80 g/mol
LogP3.05
Rot. Bonds6

About 2-[1-(3-chlorophenyl)propylamino]-N-cyclopropylpropanamide

2-[1-(3-chlorophenyl)propylamino]-N-cyclopropylpropanamide (PubChem CID 112551799) has the molecular formula C15H21ClN2O and a molecular weight of 280.80 g/mol. Its IUPAC name is 2-[1-(3-chlorophenyl)propylamino]-N-cyclopropylpropanamide.

Molecular Properties

Compound Name2-[1-(3-chlorophenyl)propylamino]-N-cyclopropylpropanamide
PubChem CID112551799
Molecular FormulaC15H21ClN2O
Molecular Weight280.80 g/mol
Exact Mass280.13
IUPAC Name2-[1-(3-chlorophenyl)propylamino]-N-cyclopropylpropanamide
SMILESCCC(NC(C)C(=O)NC1CC1)c1cccc(Cl)c1
InChIInChI=1S/C15H21ClN2O/c1-3-14(11-5-4-6-12(16)9-11)17-10(2)15(19)18-13-7-8-13/h4-6,9-10,13-14,17H,3,7-8H2,1-2H3,(H,18,19)
InChIKeyUKAIWVCRRPLEAS-UHFFFAOYSA-N
XLogP3.05
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.80
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[1-(3-chlorophenyl)propylamino]-N-cyclopropylpropanamide 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

2-[1-(4-chlorophenyl)propylamino]-N-cyclopropylpropanamide
CID 115576766
2-[[(1S)-1-(3-chlorophenyl)ethyl]amino]-N-cyclohexylpropanamide
CID 81371173
N-(4-aminocyclohexyl)-2-(3-chlorophenyl)-3-methylbutanamide
CID 119476760
N-(4-aminocyclohexyl)-2-(3-chlorophenyl)propanamide;hydrochloride
CID 119478530
1-(3-chlorophenyl)-N-[1-(3-chlorophenyl)ethyl]propan-1-amine
CID 43103044
N-[1-(3-chlorophenyl)propyl]-1-cyclohexylpropan-1-amine
CID 63477846
4-N-[1-(3-chlorophenyl)propyl]cyclohexane-1,4-diamine
CID 62314574
2-N-[1-(3-chlorophenyl)propyl]propane-1,2-diamine
CID 103387962
3-[1-(3-chlorophenyl)propylamino]cyclohexane-1-carboxylic acid
CID 65066383
N-[1-(3-chlorophenyl)propyl]-3-methylbutan-2-amine
CID 43131327
(2S)-2-(3-chlorophenoxy)-N-cyclopropylpropanamide
CID 7722254
N-butan-2-yl-2-[1-(3-chlorophenyl)ethylamino]propanamide
CID 60719366

Frequently Asked Questions

What is the IUPAC name of 2-[1-(3-chlorophenyl)propylamino]-N-cyclopropylpropanamide?
The IUPAC name of 2-[1-(3-chlorophenyl)propylamino]-N-cyclopropylpropanamide (CID 112551799) is 2-[1-(3-chlorophenyl)propylamino]-N-cyclopropylpropanamide.
What is the SMILES notation for 2-[1-(3-chlorophenyl)propylamino]-N-cyclopropylpropanamide?
The canonical SMILES for 2-[1-(3-chlorophenyl)propylamino]-N-cyclopropylpropanamide is CCC(NC(C)C(=O)NC1CC1)c1cccc(Cl)c1.
What is the InChIKey of 2-[1-(3-chlorophenyl)propylamino]-N-cyclopropylpropanamide?
The InChIKey is UKAIWVCRRPLEAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O/c1-3-14(11-5-4-6-12(16)9-11)17-10(2)15(19)18-13-7-8-13/h4-6,9-10,13-14,17H,3,7-8H2,1-2H3,(H,18,19).
What are the key properties of 2-[1-(3-chlorophenyl)propylamino]-N-cyclopropylpropanamide?
2-[1-(3-chlorophenyl)propylamino]-N-cyclopropylpropanamide has a molecular weight of 280.80 g/mol, XLogP of 3.05, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(3-chlorophenyl)propylamino]-N-cyclopropylpropanamide is sourced from PubChem (CID 112551799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).