3-[(1-ethylpiperidin-4-yl)amino]cyclohexan-1-ol

C13H26N2O — CID 43751168

IUPAC3-[(1-ethylpiperidin-4-yl)amino]cyclohexan-1-ol
SMILESCCN1CCC(NC2CCCC(O)C2)CC1
InChIInChI=1S/C13H26N2O/c1-2-15-8-6-11(7-9-15)14-12-4-3-5-13(16)10-12/h11-14,16H,2-10H2,1H3
InChIKeyWESNALQMOCLORV-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.36
Rot. Bonds3

About 3-[(1-ethylpiperidin-4-yl)amino]cyclohexan-1-ol

3-[(1-ethylpiperidin-4-yl)amino]cyclohexan-1-ol (PubChem CID 43751168) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 3-[(1-ethylpiperidin-4-yl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name3-[(1-ethylpiperidin-4-yl)amino]cyclohexan-1-ol
PubChem CID43751168
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name3-[(1-ethylpiperidin-4-yl)amino]cyclohexan-1-ol
SMILESCCN1CCC(NC2CCCC(O)C2)CC1
InChIInChI=1S/C13H26N2O/c1-2-15-8-6-11(7-9-15)14-12-4-3-5-13(16)10-12/h11-14,16H,2-10H2,1H3
InChIKeyWESNALQMOCLORV-UHFFFAOYSA-N
XLogP1.36
TPSA35.50 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 ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[(1-ethylpiperidin-4-yl)amino]cyclohexan-1-ol?
The IUPAC name of 3-[(1-ethylpiperidin-4-yl)amino]cyclohexan-1-ol (CID 43751168) is 3-[(1-ethylpiperidin-4-yl)amino]cyclohexan-1-ol.
What is the SMILES notation for 3-[(1-ethylpiperidin-4-yl)amino]cyclohexan-1-ol?
The canonical SMILES for 3-[(1-ethylpiperidin-4-yl)amino]cyclohexan-1-ol is CCN1CCC(NC2CCCC(O)C2)CC1.
What is the InChIKey of 3-[(1-ethylpiperidin-4-yl)amino]cyclohexan-1-ol?
The InChIKey is WESNALQMOCLORV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-2-15-8-6-11(7-9-15)14-12-4-3-5-13(16)10-12/h11-14,16H,2-10H2,1H3.
What are the key properties of 3-[(1-ethylpiperidin-4-yl)amino]cyclohexan-1-ol?
3-[(1-ethylpiperidin-4-yl)amino]cyclohexan-1-ol has a molecular weight of 226.36 g/mol, XLogP of 1.36, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-ethylpiperidin-4-yl)amino]cyclohexan-1-ol is sourced from PubChem (CID 43751168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).