1-[(4-ethylphenyl)methyl]piperidin-4-ol

C14H21NO — CID 792644

IUPAC1-[(4-ethylphenyl)methyl]piperidin-4-ol
SMILESCCc1ccc(CN2CCC(O)CC2)cc1
InChIInChI=1S/C14H21NO/c1-2-12-3-5-13(6-4-12)11-15-9-7-14(16)8-10-15/h3-6,14,16H,2,7-11H2,1H3
InChIKeyNYBSYWQQNHVGJR-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.21
Rot. Bonds3

About 1-[(4-ethylphenyl)methyl]piperidin-4-ol

1-[(4-ethylphenyl)methyl]piperidin-4-ol (PubChem CID 792644) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-[(4-ethylphenyl)methyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[(4-ethylphenyl)methyl]piperidin-4-ol
PubChem CID792644
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name1-[(4-ethylphenyl)methyl]piperidin-4-ol
SMILESCCc1ccc(CN2CCC(O)CC2)cc1
InChIInChI=1S/C14H21NO/c1-2-12-3-5-13(6-4-12)11-15-9-7-14(16)8-10-15/h3-6,14,16H,2,7-11H2,1H3
InChIKeyNYBSYWQQNHVGJR-UHFFFAOYSA-N
XLogP2.21
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-ethylphenyl)methyl]piperidin-4-ol?
The IUPAC name of 1-[(4-ethylphenyl)methyl]piperidin-4-ol (CID 792644) is 1-[(4-ethylphenyl)methyl]piperidin-4-ol.
What is the SMILES notation for 1-[(4-ethylphenyl)methyl]piperidin-4-ol?
The canonical SMILES for 1-[(4-ethylphenyl)methyl]piperidin-4-ol is CCc1ccc(CN2CCC(O)CC2)cc1.
What is the InChIKey of 1-[(4-ethylphenyl)methyl]piperidin-4-ol?
The InChIKey is NYBSYWQQNHVGJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-2-12-3-5-13(6-4-12)11-15-9-7-14(16)8-10-15/h3-6,14,16H,2,7-11H2,1H3.
What are the key properties of 1-[(4-ethylphenyl)methyl]piperidin-4-ol?
1-[(4-ethylphenyl)methyl]piperidin-4-ol has a molecular weight of 219.33 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-ethylphenyl)methyl]piperidin-4-ol is sourced from PubChem (CID 792644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).