2-[(4-aminocyclohexyl)-propylamino]-N-cyclopentylpropanamide

C17H33N3O — CID 79117291

IUPAC2-[(4-aminocyclohexyl)-propylamino]-N-cyclopentylpropanamide
SMILESCCCN(C1CCC(N)CC1)C(C)C(=O)NC1CCCC1
InChIInChI=1S/C17H33N3O/c1-3-12-20(16-10-8-14(18)9-11-16)13(2)17(21)19-15-6-4-5-7-15/h13-16H,3-12,18H2,1-2H3,(H,19,21)
InChIKeyLMUXXHDEDAUTFD-UHFFFAOYSA-N
MW295.47 g/mol
LogP2.42
Rot. Bonds6

About 2-[(4-aminocyclohexyl)-propylamino]-N-cyclopentylpropanamide

2-[(4-aminocyclohexyl)-propylamino]-N-cyclopentylpropanamide (PubChem CID 79117291) has the molecular formula C17H33N3O and a molecular weight of 295.47 g/mol. Its IUPAC name is 2-[(4-aminocyclohexyl)-propylamino]-N-cyclopentylpropanamide.

Molecular Properties

Compound Name2-[(4-aminocyclohexyl)-propylamino]-N-cyclopentylpropanamide
PubChem CID79117291
Molecular FormulaC17H33N3O
Molecular Weight295.47 g/mol
Exact Mass295.26
IUPAC Name2-[(4-aminocyclohexyl)-propylamino]-N-cyclopentylpropanamide
SMILESCCCN(C1CCC(N)CC1)C(C)C(=O)NC1CCCC1
InChIInChI=1S/C17H33N3O/c1-3-12-20(16-10-8-14(18)9-11-16)13(2)17(21)19-15-6-4-5-7-15/h13-16H,3-12,18H2,1-2H3,(H,19,21)
InChIKeyLMUXXHDEDAUTFD-UHFFFAOYSA-N
XLogP2.42
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.47
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[(4-aminocyclohexyl)-propylamino]-N-cyclopentylpropanamide 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-[(4-aminocyclohexyl)-ethylamino]-N-cyclohexylpropanamide
CID 79114794
2-[(4-aminocyclohexyl)-propylamino]-N-propylpropanamide
CID 79112238
2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopentylpropanamide
CID 43137529
2-[2-aminoethyl(cyclobutyl)amino]-N-cyclohexylpropanamide
CID 102875118
2-[(4-aminocyclohexyl)-propylamino]-N,N-dimethylpropanamide
CID 79112315
4-N-(1-cyclohexylethyl)-4-N-propylcyclohexane-1,4-diamine
CID 79111630
2-[cyclopropyl(propyl)amino]propanoic acid
CID 43270597
2-[(4-aminocyclohexyl)-ethylamino]-N-(2-methylbutan-2-yl)propanamide
CID 79115626
4-N-(3-methylbutan-2-yl)-4-N-propylcyclohexane-1,4-diamine
CID 79112216
methyl 2-[[1-(cyclohexylamino)-1-oxopropan-2-yl]-propylamino]acetate
CID 62011561
2-(4-amino-N-propylanilino)-N-cyclopentylpropanamide
CID 63233776
2-[3-aminopropyl(cyclopentyl)amino]-N-propylpropanamide
CID 43137600

Frequently Asked Questions

What is the IUPAC name of 2-[(4-aminocyclohexyl)-propylamino]-N-cyclopentylpropanamide?
The IUPAC name of 2-[(4-aminocyclohexyl)-propylamino]-N-cyclopentylpropanamide (CID 79117291) is 2-[(4-aminocyclohexyl)-propylamino]-N-cyclopentylpropanamide.
What is the SMILES notation for 2-[(4-aminocyclohexyl)-propylamino]-N-cyclopentylpropanamide?
The canonical SMILES for 2-[(4-aminocyclohexyl)-propylamino]-N-cyclopentylpropanamide is CCCN(C1CCC(N)CC1)C(C)C(=O)NC1CCCC1.
What is the InChIKey of 2-[(4-aminocyclohexyl)-propylamino]-N-cyclopentylpropanamide?
The InChIKey is LMUXXHDEDAUTFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N3O/c1-3-12-20(16-10-8-14(18)9-11-16)13(2)17(21)19-15-6-4-5-7-15/h13-16H,3-12,18H2,1-2H3,(H,19,21).
What are the key properties of 2-[(4-aminocyclohexyl)-propylamino]-N-cyclopentylpropanamide?
2-[(4-aminocyclohexyl)-propylamino]-N-cyclopentylpropanamide has a molecular weight of 295.47 g/mol, XLogP of 2.42, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-aminocyclohexyl)-propylamino]-N-cyclopentylpropanamide is sourced from PubChem (CID 79117291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).