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

C13H19NO2 — CID 10013773

IUPAC1-[(4-methoxyphenyl)methyl]piperidin-4-ol
SMILESCOc1ccc(CN2CCC(O)CC2)cc1
InChIInChI=1S/C13H19NO2/c1-16-13-4-2-11(3-5-13)10-14-8-6-12(15)7-9-14/h2-5,12,15H,6-10H2,1H3
InChIKeyNQVMHMLNRGHKEX-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.65
Rot. Bonds3

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

1-[(4-methoxyphenyl)methyl]piperidin-4-ol (PubChem CID 10013773) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 1-[(4-methoxyphenyl)methyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[(4-methoxyphenyl)methyl]piperidin-4-ol
PubChem CID10013773
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name1-[(4-methoxyphenyl)methyl]piperidin-4-ol
SMILESCOc1ccc(CN2CCC(O)CC2)cc1
InChIInChI=1S/C13H19NO2/c1-16-13-4-2-11(3-5-13)10-14-8-6-12(15)7-9-14/h2-5,12,15H,6-10H2,1H3
InChIKeyNQVMHMLNRGHKEX-UHFFFAOYSA-N
XLogP1.65
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-methoxyphenyl)methyl]piperidin-4-ol?
The IUPAC name of 1-[(4-methoxyphenyl)methyl]piperidin-4-ol (CID 10013773) is 1-[(4-methoxyphenyl)methyl]piperidin-4-ol.
What is the SMILES notation for 1-[(4-methoxyphenyl)methyl]piperidin-4-ol?
The canonical SMILES for 1-[(4-methoxyphenyl)methyl]piperidin-4-ol is COc1ccc(CN2CCC(O)CC2)cc1.
What is the InChIKey of 1-[(4-methoxyphenyl)methyl]piperidin-4-ol?
The InChIKey is NQVMHMLNRGHKEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-16-13-4-2-11(3-5-13)10-14-8-6-12(15)7-9-14/h2-5,12,15H,6-10H2,1H3.
What are the key properties of 1-[(4-methoxyphenyl)methyl]piperidin-4-ol?
1-[(4-methoxyphenyl)methyl]piperidin-4-ol has a molecular weight of 221.30 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-methoxyphenyl)methyl]piperidin-4-ol is sourced from PubChem (CID 10013773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).