[6-(4-ethylphenyl)piperidin-3-yl]methanol

C14H21NO — CID 117000409

IUPAC[6-(4-ethylphenyl)piperidin-3-yl]methanol
SMILESCCc1ccc(C2CCC(CO)CN2)cc1
InChIInChI=1S/C14H21NO/c1-2-11-3-6-13(7-4-11)14-8-5-12(10-16)9-15-14/h3-4,6-7,12,14-16H,2,5,8-10H2,1H3
InChIKeyRQCNFVYDONOREJ-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.28
Rot. Bonds3

About [6-(4-ethylphenyl)piperidin-3-yl]methanol

[6-(4-ethylphenyl)piperidin-3-yl]methanol (PubChem CID 117000409) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is [6-(4-ethylphenyl)piperidin-3-yl]methanol.

Molecular Properties

Compound Name[6-(4-ethylphenyl)piperidin-3-yl]methanol
PubChem CID117000409
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name[6-(4-ethylphenyl)piperidin-3-yl]methanol
SMILESCCc1ccc(C2CCC(CO)CN2)cc1
InChIInChI=1S/C14H21NO/c1-2-11-3-6-13(7-4-11)14-8-5-12(10-16)9-15-14/h3-4,6-7,12,14-16H,2,5,8-10H2,1H3
InChIKeyRQCNFVYDONOREJ-UHFFFAOYSA-N
XLogP2.28
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [6-(4-ethylphenyl)piperidin-3-yl]methanol?
The IUPAC name of [6-(4-ethylphenyl)piperidin-3-yl]methanol (CID 117000409) is [6-(4-ethylphenyl)piperidin-3-yl]methanol.
What is the SMILES notation for [6-(4-ethylphenyl)piperidin-3-yl]methanol?
The canonical SMILES for [6-(4-ethylphenyl)piperidin-3-yl]methanol is CCc1ccc(C2CCC(CO)CN2)cc1.
What is the InChIKey of [6-(4-ethylphenyl)piperidin-3-yl]methanol?
The InChIKey is RQCNFVYDONOREJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-2-11-3-6-13(7-4-11)14-8-5-12(10-16)9-15-14/h3-4,6-7,12,14-16H,2,5,8-10H2,1H3.
What are the key properties of [6-(4-ethylphenyl)piperidin-3-yl]methanol?
[6-(4-ethylphenyl)piperidin-3-yl]methanol has a molecular weight of 219.33 g/mol, XLogP of 2.28, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(4-ethylphenyl)piperidin-3-yl]methanol is sourced from PubChem (CID 117000409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).