[1-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)cyclopentyl]methanol

C16H30N2O — CID 79657108

IUPAC[1-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)cyclopentyl]methanol
SMILESCCC1CCCCN1C1CCC(CO)(NC2CC2)C1
InChIInChI=1S/C16H30N2O/c1-2-14-5-3-4-10-18(14)15-8-9-16(11-15,12-19)17-13-6-7-13/h13-15,17,19H,2-12H2,1H3
InChIKeyAFXURDDBEABMJY-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.29
Rot. Bonds5

About [1-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)cyclopentyl]methanol

[1-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)cyclopentyl]methanol (PubChem CID 79657108) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is [1-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)cyclopentyl]methanol
PubChem CID79657108
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name[1-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)cyclopentyl]methanol
SMILESCCC1CCCCN1C1CCC(CO)(NC2CC2)C1
InChIInChI=1S/C16H30N2O/c1-2-14-5-3-4-10-18(14)15-8-9-16(11-15,12-19)17-13-6-7-13/h13-15,17,19H,2-12H2,1H3
InChIKeyAFXURDDBEABMJY-UHFFFAOYSA-N
XLogP2.29
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)cyclopentyl]methanol?
The IUPAC name of [1-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)cyclopentyl]methanol (CID 79657108) is [1-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)cyclopentyl]methanol.
What is the SMILES notation for [1-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)cyclopentyl]methanol?
The canonical SMILES for [1-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)cyclopentyl]methanol is CCC1CCCCN1C1CCC(CO)(NC2CC2)C1.
What is the InChIKey of [1-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)cyclopentyl]methanol?
The InChIKey is AFXURDDBEABMJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-2-14-5-3-4-10-18(14)15-8-9-16(11-15,12-19)17-13-6-7-13/h13-15,17,19H,2-12H2,1H3.
What are the key properties of [1-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)cyclopentyl]methanol?
[1-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)cyclopentyl]methanol has a molecular weight of 266.43 g/mol, XLogP of 2.29, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)cyclopentyl]methanol is sourced from PubChem (CID 79657108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).