3-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)propan-1-ol

C13H26N2O — CID 64797687

IUPAC3-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)propan-1-ol
SMILESCCN(CC(CO)NC1CC1)C1CCCC1
InChIInChI=1S/C13H26N2O/c1-2-15(13-5-3-4-6-13)9-12(10-16)14-11-7-8-11/h11-14,16H,2-10H2,1H3
InChIKeyAIPVGHSJWDAQGS-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.36
Rot. Bonds7

About 3-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)propan-1-ol

3-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)propan-1-ol (PubChem CID 64797687) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 3-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)propan-1-ol.

Molecular Properties

Compound Name3-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)propan-1-ol
PubChem CID64797687
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name3-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)propan-1-ol
SMILESCCN(CC(CO)NC1CC1)C1CCCC1
InChIInChI=1S/C13H26N2O/c1-2-15(13-5-3-4-6-13)9-12(10-16)14-11-7-8-11/h11-14,16H,2-10H2,1H3
InChIKeyAIPVGHSJWDAQGS-UHFFFAOYSA-N
XLogP1.36
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)propan-1-ol 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-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)butan-1-ol
CID 64795522
2-(cyclopropylamino)-3-(dicyclohexylamino)propan-1-ol
CID 64790779
3-[cyclobutylmethyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol
CID 64787425
2-[(4-methylcycloheptyl)amino]butan-1-ol
CID 65081279
3-[cyclohexylmethyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol
CID 64827404
(2S)-2-(cyclooctylamino)butan-1-ol
CID 28723227
1-N-cyclopentyl-1-N-ethyl-2-N-propylbutane-1,2-diamine
CID 62038216
1-[cyclopentyl(ethyl)amino]butan-2-ol
CID 60886562
N'-cyclohexyl-1-cyclopropyl-N'-ethyl-N-methylethane-1,2-diamine
CID 63912104
4-[cyclohexyl(ethyl)amino]-2-(propylamino)butan-1-ol
CID 64798399
2-(cyclopropylamino)-3-[methyl(pentan-2-yl)amino]propan-1-ol
CID 64797729
3-[butyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol
CID 64791382

Frequently Asked Questions

What is the IUPAC name of 3-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)propan-1-ol?
The IUPAC name of 3-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)propan-1-ol (CID 64797687) is 3-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)propan-1-ol.
What is the SMILES notation for 3-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)propan-1-ol?
The canonical SMILES for 3-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)propan-1-ol is CCN(CC(CO)NC1CC1)C1CCCC1.
What is the InChIKey of 3-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)propan-1-ol?
The InChIKey is AIPVGHSJWDAQGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-2-15(13-5-3-4-6-13)9-12(10-16)14-11-7-8-11/h11-14,16H,2-10H2,1H3.
What are the key properties of 3-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)propan-1-ol?
3-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)propan-1-ol has a molecular weight of 226.36 g/mol, XLogP of 1.36, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)propan-1-ol is sourced from PubChem (CID 64797687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).