[4-(1-methylpiperidin-3-yl)phenyl]methanol

C13H19NO — CID 58393220

IUPAC[4-(1-methylpiperidin-3-yl)phenyl]methanol
SMILESCN1CCCC(c2ccc(CO)cc2)C1
InChIInChI=1S/C13H19NO/c1-14-8-2-3-13(9-14)12-6-4-11(10-15)5-7-12/h4-7,13,15H,2-3,8-10H2,1H3
InChIKeyGVJZHYQYADOXRO-UHFFFAOYSA-N
MW205.30 g/mol
LogP1.99
Rot. Bonds2

About [4-(1-methylpiperidin-3-yl)phenyl]methanol

[4-(1-methylpiperidin-3-yl)phenyl]methanol (PubChem CID 58393220) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is [4-(1-methylpiperidin-3-yl)phenyl]methanol.

Molecular Properties

Compound Name[4-(1-methylpiperidin-3-yl)phenyl]methanol
PubChem CID58393220
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name[4-(1-methylpiperidin-3-yl)phenyl]methanol
SMILESCN1CCCC(c2ccc(CO)cc2)C1
InChIInChI=1S/C13H19NO/c1-14-8-2-3-13(9-14)12-6-4-11(10-15)5-7-12/h4-7,13,15H,2-3,8-10H2,1H3
InChIKeyGVJZHYQYADOXRO-UHFFFAOYSA-N
XLogP1.99
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(1-methylpiperidin-3-yl)phenyl]methanol?
The IUPAC name of [4-(1-methylpiperidin-3-yl)phenyl]methanol (CID 58393220) is [4-(1-methylpiperidin-3-yl)phenyl]methanol.
What is the SMILES notation for [4-(1-methylpiperidin-3-yl)phenyl]methanol?
The canonical SMILES for [4-(1-methylpiperidin-3-yl)phenyl]methanol is CN1CCCC(c2ccc(CO)cc2)C1.
What is the InChIKey of [4-(1-methylpiperidin-3-yl)phenyl]methanol?
The InChIKey is GVJZHYQYADOXRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-14-8-2-3-13(9-14)12-6-4-11(10-15)5-7-12/h4-7,13,15H,2-3,8-10H2,1H3.
What are the key properties of [4-(1-methylpiperidin-3-yl)phenyl]methanol?
[4-(1-methylpiperidin-3-yl)phenyl]methanol has a molecular weight of 205.30 g/mol, XLogP of 1.99, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1-methylpiperidin-3-yl)phenyl]methanol is sourced from PubChem (CID 58393220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).