[1-amino-3-(4-ethylpiperidin-1-yl)cyclopentyl]methanol

C13H26N2O — CID 79655902

IUPAC[1-amino-3-(4-ethylpiperidin-1-yl)cyclopentyl]methanol
SMILESCCC1CCN(C2CCC(N)(CO)C2)CC1
InChIInChI=1S/C13H26N2O/c1-2-11-4-7-15(8-5-11)12-3-6-13(14,9-12)10-16/h11-12,16H,2-10,14H2,1H3
InChIKeyQDZXWFWMNBRXNX-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.35
Rot. Bonds3

About [1-amino-3-(4-ethylpiperidin-1-yl)cyclopentyl]methanol

[1-amino-3-(4-ethylpiperidin-1-yl)cyclopentyl]methanol (PubChem CID 79655902) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is [1-amino-3-(4-ethylpiperidin-1-yl)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-amino-3-(4-ethylpiperidin-1-yl)cyclopentyl]methanol
PubChem CID79655902
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name[1-amino-3-(4-ethylpiperidin-1-yl)cyclopentyl]methanol
SMILESCCC1CCN(C2CCC(N)(CO)C2)CC1
InChIInChI=1S/C13H26N2O/c1-2-11-4-7-15(8-5-11)12-3-6-13(14,9-12)10-16/h11-12,16H,2-10,14H2,1H3
InChIKeyQDZXWFWMNBRXNX-UHFFFAOYSA-N
XLogP1.35
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-amino-3-(4-ethylpiperidin-1-yl)cyclopentyl]methanol?
The IUPAC name of [1-amino-3-(4-ethylpiperidin-1-yl)cyclopentyl]methanol (CID 79655902) is [1-amino-3-(4-ethylpiperidin-1-yl)cyclopentyl]methanol.
What is the SMILES notation for [1-amino-3-(4-ethylpiperidin-1-yl)cyclopentyl]methanol?
The canonical SMILES for [1-amino-3-(4-ethylpiperidin-1-yl)cyclopentyl]methanol is CCC1CCN(C2CCC(N)(CO)C2)CC1.
What is the InChIKey of [1-amino-3-(4-ethylpiperidin-1-yl)cyclopentyl]methanol?
The InChIKey is QDZXWFWMNBRXNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-2-11-4-7-15(8-5-11)12-3-6-13(14,9-12)10-16/h11-12,16H,2-10,14H2,1H3.
What are the key properties of [1-amino-3-(4-ethylpiperidin-1-yl)cyclopentyl]methanol?
[1-amino-3-(4-ethylpiperidin-1-yl)cyclopentyl]methanol has a molecular weight of 226.36 g/mol, XLogP of 1.35, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-amino-3-(4-ethylpiperidin-1-yl)cyclopentyl]methanol is sourced from PubChem (CID 79655902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).