1-[4-(1-methylpiperidin-4-yl)phenyl]ethanol

C14H21NO — CID 58103926

IUPAC1-[4-(1-methylpiperidin-4-yl)phenyl]ethanol
SMILESCC(O)c1ccc(C2CCN(C)CC2)cc1
InChIInChI=1S/C14H21NO/c1-11(16)12-3-5-13(6-4-12)14-7-9-15(2)10-8-14/h3-6,11,14,16H,7-10H2,1-2H3
InChIKeyXYYZNNDIWWKZDP-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.55
Rot. Bonds2

About 1-[4-(1-methylpiperidin-4-yl)phenyl]ethanol

1-[4-(1-methylpiperidin-4-yl)phenyl]ethanol (PubChem CID 58103926) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-[4-(1-methylpiperidin-4-yl)phenyl]ethanol.

Molecular Properties

Compound Name1-[4-(1-methylpiperidin-4-yl)phenyl]ethanol
PubChem CID58103926
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name1-[4-(1-methylpiperidin-4-yl)phenyl]ethanol
SMILESCC(O)c1ccc(C2CCN(C)CC2)cc1
InChIInChI=1S/C14H21NO/c1-11(16)12-3-5-13(6-4-12)14-7-9-15(2)10-8-14/h3-6,11,14,16H,7-10H2,1-2H3
InChIKeyXYYZNNDIWWKZDP-UHFFFAOYSA-N
XLogP2.55
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(1-methylpiperidin-4-yl)phenyl]ethanol?
The IUPAC name of 1-[4-(1-methylpiperidin-4-yl)phenyl]ethanol (CID 58103926) is 1-[4-(1-methylpiperidin-4-yl)phenyl]ethanol.
What is the SMILES notation for 1-[4-(1-methylpiperidin-4-yl)phenyl]ethanol?
The canonical SMILES for 1-[4-(1-methylpiperidin-4-yl)phenyl]ethanol is CC(O)c1ccc(C2CCN(C)CC2)cc1.
What is the InChIKey of 1-[4-(1-methylpiperidin-4-yl)phenyl]ethanol?
The InChIKey is XYYZNNDIWWKZDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-11(16)12-3-5-13(6-4-12)14-7-9-15(2)10-8-14/h3-6,11,14,16H,7-10H2,1-2H3.
What are the key properties of 1-[4-(1-methylpiperidin-4-yl)phenyl]ethanol?
1-[4-(1-methylpiperidin-4-yl)phenyl]ethanol has a molecular weight of 219.33 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(1-methylpiperidin-4-yl)phenyl]ethanol is sourced from PubChem (CID 58103926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).