1-(4-ethylpiperidin-2-yl)-2,4-dimethylcyclohexan-1-ol

C15H29NO — CID 64754596

IUPAC1-(4-ethylpiperidin-2-yl)-2,4-dimethylcyclohexan-1-ol
SMILESCCC1CCNC(C2(O)CCC(C)CC2C)C1
InChIInChI=1S/C15H29NO/c1-4-13-6-8-16-14(10-13)15(17)7-5-11(2)9-12(15)3/h11-14,16-17H,4-10H2,1-3H3
InChIKeyRNTYUEUUEGGFQU-UHFFFAOYSA-N
MW239.40 g/mol
LogP2.95
Rot. Bonds2

About 1-(4-ethylpiperidin-2-yl)-2,4-dimethylcyclohexan-1-ol

1-(4-ethylpiperidin-2-yl)-2,4-dimethylcyclohexan-1-ol (PubChem CID 64754596) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is 1-(4-ethylpiperidin-2-yl)-2,4-dimethylcyclohexan-1-ol.

Molecular Properties

Compound Name1-(4-ethylpiperidin-2-yl)-2,4-dimethylcyclohexan-1-ol
PubChem CID64754596
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name1-(4-ethylpiperidin-2-yl)-2,4-dimethylcyclohexan-1-ol
SMILESCCC1CCNC(C2(O)CCC(C)CC2C)C1
InChIInChI=1S/C15H29NO/c1-4-13-6-8-16-14(10-13)15(17)7-5-11(2)9-12(15)3/h11-14,16-17H,4-10H2,1-3H3
InChIKeyRNTYUEUUEGGFQU-UHFFFAOYSA-N
XLogP2.95
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylpiperidin-2-yl)-2,4-dimethylcyclohexan-1-ol?
The IUPAC name of 1-(4-ethylpiperidin-2-yl)-2,4-dimethylcyclohexan-1-ol (CID 64754596) is 1-(4-ethylpiperidin-2-yl)-2,4-dimethylcyclohexan-1-ol.
What is the SMILES notation for 1-(4-ethylpiperidin-2-yl)-2,4-dimethylcyclohexan-1-ol?
The canonical SMILES for 1-(4-ethylpiperidin-2-yl)-2,4-dimethylcyclohexan-1-ol is CCC1CCNC(C2(O)CCC(C)CC2C)C1.
What is the InChIKey of 1-(4-ethylpiperidin-2-yl)-2,4-dimethylcyclohexan-1-ol?
The InChIKey is RNTYUEUUEGGFQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-4-13-6-8-16-14(10-13)15(17)7-5-11(2)9-12(15)3/h11-14,16-17H,4-10H2,1-3H3.
What are the key properties of 1-(4-ethylpiperidin-2-yl)-2,4-dimethylcyclohexan-1-ol?
1-(4-ethylpiperidin-2-yl)-2,4-dimethylcyclohexan-1-ol has a molecular weight of 239.40 g/mol, XLogP of 2.95, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylpiperidin-2-yl)-2,4-dimethylcyclohexan-1-ol is sourced from PubChem (CID 64754596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).