1-hydroxy-4-[(4-methoxyphenyl)methyl]piperidine

C13H19NO2 — CID 122445485

IUPAC1-hydroxy-4-[(4-methoxyphenyl)methyl]piperidine
SMILESCOc1ccc(CC2CCN(O)CC2)cc1
InChIInChI=1S/C13H19NO2/c1-16-13-4-2-11(3-5-13)10-12-6-8-14(15)9-7-12/h2-5,12,15H,6-10H2,1H3
InChIKeyKSJACDKMSYHNFI-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.34
Rot. Bonds3

About 1-hydroxy-4-[(4-methoxyphenyl)methyl]piperidine

1-hydroxy-4-[(4-methoxyphenyl)methyl]piperidine (PubChem CID 122445485) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 1-hydroxy-4-[(4-methoxyphenyl)methyl]piperidine.

Molecular Properties

Compound Name1-hydroxy-4-[(4-methoxyphenyl)methyl]piperidine
PubChem CID122445485
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name1-hydroxy-4-[(4-methoxyphenyl)methyl]piperidine
SMILESCOc1ccc(CC2CCN(O)CC2)cc1
InChIInChI=1S/C13H19NO2/c1-16-13-4-2-11(3-5-13)10-12-6-8-14(15)9-7-12/h2-5,12,15H,6-10H2,1H3
InChIKeyKSJACDKMSYHNFI-UHFFFAOYSA-N
XLogP2.34
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 ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(cyclopropylmethyl)-4-methoxybenzene
CID 6422476
4-[4-[(4-methoxyphenyl)methyl]piperidin-1-yl]butan-1-ol
CID 110931792
2-[4-[(4-methoxyphenyl)methyl]piperidin-1-yl]propanamide
CID 47091693
[2-[4-[(4-methoxyphenyl)methyl]piperidin-1-yl]-2-oxoethyl] acetate
CID 46086832
(1-hydroxycyclopentyl)-[4-[(4-methoxyphenyl)methyl]piperidin-1-yl]methanone
CID 110912966
1-[4-[(4-methoxyphenyl)methyl]piperidin-1-yl]pent-4-en-1-one
CID 46086884
N-carbamoyl-3-[4-[(4-methoxyphenyl)methyl]piperidin-1-yl]propanamide
CID 47091691
3-[4-[(4-methoxyphenyl)methyl]piperidin-1-yl]-1-piperazin-1-ylpropan-1-one
CID 120981397
(2S)-2-amino-1-[4-[(4-methoxyphenyl)methyl]piperidin-1-yl]-3,3-dimethylbutan-1-one;hydrochloride
CID 119765846
1-[2-(4-fluorophenoxy)ethyl]-4-[(4-methoxyphenyl)methyl]piperidine;hydrochloride
CID 23294491
3-[(4-methoxyphenyl)methyl]azetidine
CID 16780470
2-amino-1-[4-[(4-methoxyphenyl)methyl]piperidin-1-yl]-3-methylpentan-1-one;hydrochloride
CID 119765862

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-4-[(4-methoxyphenyl)methyl]piperidine?
The IUPAC name of 1-hydroxy-4-[(4-methoxyphenyl)methyl]piperidine (CID 122445485) is 1-hydroxy-4-[(4-methoxyphenyl)methyl]piperidine.
What is the SMILES notation for 1-hydroxy-4-[(4-methoxyphenyl)methyl]piperidine?
The canonical SMILES for 1-hydroxy-4-[(4-methoxyphenyl)methyl]piperidine is COc1ccc(CC2CCN(O)CC2)cc1.
What is the InChIKey of 1-hydroxy-4-[(4-methoxyphenyl)methyl]piperidine?
The InChIKey is KSJACDKMSYHNFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-16-13-4-2-11(3-5-13)10-12-6-8-14(15)9-7-12/h2-5,12,15H,6-10H2,1H3.
What are the key properties of 1-hydroxy-4-[(4-methoxyphenyl)methyl]piperidine?
1-hydroxy-4-[(4-methoxyphenyl)methyl]piperidine has a molecular weight of 221.30 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-4-[(4-methoxyphenyl)methyl]piperidine is sourced from PubChem (CID 122445485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).