2-[3-aminopropyl(cyclohexyl)amino]-N-cyclopentylacetamide

C16H31N3O — CID 43319655

IUPAC2-[3-aminopropyl(cyclohexyl)amino]-N-cyclopentylacetamide
SMILESNCCCN(CC(=O)NC1CCCC1)C1CCCCC1
InChIInChI=1S/C16H31N3O/c17-11-6-12-19(15-9-2-1-3-10-15)13-16(20)18-14-7-4-5-8-14/h14-15H,1-13,17H2,(H,18,20)
InChIKeyZARRPJSPAQXAKE-UHFFFAOYSA-N
MW281.44 g/mol
LogP2.03
Rot. Bonds7

About 2-[3-aminopropyl(cyclohexyl)amino]-N-cyclopentylacetamide

2-[3-aminopropyl(cyclohexyl)amino]-N-cyclopentylacetamide (PubChem CID 43319655) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is 2-[3-aminopropyl(cyclohexyl)amino]-N-cyclopentylacetamide.

Molecular Properties

Compound Name2-[3-aminopropyl(cyclohexyl)amino]-N-cyclopentylacetamide
PubChem CID43319655
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC Name2-[3-aminopropyl(cyclohexyl)amino]-N-cyclopentylacetamide
SMILESNCCCN(CC(=O)NC1CCCC1)C1CCCCC1
InChIInChI=1S/C16H31N3O/c17-11-6-12-19(15-9-2-1-3-10-15)13-16(20)18-14-7-4-5-8-14/h14-15H,1-13,17H2,(H,18,20)
InChIKeyZARRPJSPAQXAKE-UHFFFAOYSA-N
XLogP2.03
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[3-aminopropyl(cyclohexyl)amino]-N-cyclopentylacetamide 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-[3-aminopropyl(cyclopentyl)amino]-N-cyclopentylacetamide
CID 43319618
2-[3-aminopropyl(cyclopropyl)amino]-N-cyclohexylacetamide
CID 43137540
2-[2-aminoethyl(cyclobutyl)amino]-N-cycloheptylacetamide
CID 102875096
2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopropylacetamide
CID 43137486
2-[2-aminoethyl(cyclopropyl)amino]-N-cycloheptylacetamide
CID 62548939
2-[cyclohexyl(2-hydroxyethyl)amino]-N-cyclopentylacetamide
CID 60694014
2-[3-aminopropyl(cyclopentyl)amino]-N-methylacetamide
CID 43137553
2-[3-aminopropyl(cyclopentyl)amino]-N-propan-2-ylacetamide
CID 43137564
2-[3-aminopropyl(cycloheptyl)amino]-N-pentan-3-ylacetamide
CID 61487094
1-(3-aminopropyl)-1-cyclobutyl-3-cyclohexylurea
CID 102874242
2-[3-aminopropyl(cycloheptyl)amino]-N-butan-2-ylacetamide
CID 43137666
2-[[2-(cyclohexylamino)-2-oxoethyl]-cyclopropylamino]acetic acid
CID 54945026

Frequently Asked Questions

What is the IUPAC name of 2-[3-aminopropyl(cyclohexyl)amino]-N-cyclopentylacetamide?
The IUPAC name of 2-[3-aminopropyl(cyclohexyl)amino]-N-cyclopentylacetamide (CID 43319655) is 2-[3-aminopropyl(cyclohexyl)amino]-N-cyclopentylacetamide.
What is the SMILES notation for 2-[3-aminopropyl(cyclohexyl)amino]-N-cyclopentylacetamide?
The canonical SMILES for 2-[3-aminopropyl(cyclohexyl)amino]-N-cyclopentylacetamide is NCCCN(CC(=O)NC1CCCC1)C1CCCCC1.
What is the InChIKey of 2-[3-aminopropyl(cyclohexyl)amino]-N-cyclopentylacetamide?
The InChIKey is ZARRPJSPAQXAKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c17-11-6-12-19(15-9-2-1-3-10-15)13-16(20)18-14-7-4-5-8-14/h14-15H,1-13,17H2,(H,18,20).
What are the key properties of 2-[3-aminopropyl(cyclohexyl)amino]-N-cyclopentylacetamide?
2-[3-aminopropyl(cyclohexyl)amino]-N-cyclopentylacetamide has a molecular weight of 281.44 g/mol, XLogP of 2.03, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-aminopropyl(cyclohexyl)amino]-N-cyclopentylacetamide is sourced from PubChem (CID 43319655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).