1-[1-(aminomethyl)-3-ethylcyclopentyl]-1-cyclopropylethanol

C13H25NO — CID 79127874

IUPAC1-[1-(aminomethyl)-3-ethylcyclopentyl]-1-cyclopropylethanol
SMILESCCC1CCC(CN)(C(C)(O)C2CC2)C1
InChIInChI=1S/C13H25NO/c1-3-10-6-7-13(8-10,9-14)12(2,15)11-4-5-11/h10-11,15H,3-9,14H2,1-2H3
InChIKeyBFFIUFWKXTZTCH-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.30
Rot. Bonds4

About 1-[1-(aminomethyl)-3-ethylcyclopentyl]-1-cyclopropylethanol

1-[1-(aminomethyl)-3-ethylcyclopentyl]-1-cyclopropylethanol (PubChem CID 79127874) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 1-[1-(aminomethyl)-3-ethylcyclopentyl]-1-cyclopropylethanol.

Molecular Properties

Compound Name1-[1-(aminomethyl)-3-ethylcyclopentyl]-1-cyclopropylethanol
PubChem CID79127874
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name1-[1-(aminomethyl)-3-ethylcyclopentyl]-1-cyclopropylethanol
SMILESCCC1CCC(CN)(C(C)(O)C2CC2)C1
InChIInChI=1S/C13H25NO/c1-3-10-6-7-13(8-10,9-14)12(2,15)11-4-5-11/h10-11,15H,3-9,14H2,1-2H3
InChIKeyBFFIUFWKXTZTCH-UHFFFAOYSA-N
XLogP2.30
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-[1-(aminomethyl)-3-ethylcyclopentyl]-1-cyclopropylethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[1-(aminomethyl)-3-ethylcyclopentyl]-1-cyclopropylethanol?
The IUPAC name of 1-[1-(aminomethyl)-3-ethylcyclopentyl]-1-cyclopropylethanol (CID 79127874) is 1-[1-(aminomethyl)-3-ethylcyclopentyl]-1-cyclopropylethanol.
What is the SMILES notation for 1-[1-(aminomethyl)-3-ethylcyclopentyl]-1-cyclopropylethanol?
The canonical SMILES for 1-[1-(aminomethyl)-3-ethylcyclopentyl]-1-cyclopropylethanol is CCC1CCC(CN)(C(C)(O)C2CC2)C1.
What is the InChIKey of 1-[1-(aminomethyl)-3-ethylcyclopentyl]-1-cyclopropylethanol?
The InChIKey is BFFIUFWKXTZTCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-3-10-6-7-13(8-10,9-14)12(2,15)11-4-5-11/h10-11,15H,3-9,14H2,1-2H3.
What are the key properties of 1-[1-(aminomethyl)-3-ethylcyclopentyl]-1-cyclopropylethanol?
1-[1-(aminomethyl)-3-ethylcyclopentyl]-1-cyclopropylethanol has a molecular weight of 211.35 g/mol, XLogP of 2.30, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(aminomethyl)-3-ethylcyclopentyl]-1-cyclopropylethanol is sourced from PubChem (CID 79127874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).