(2-hydroxyphenyl)-(3-methylpiperidin-1-yl)methanone

C13H17NO2 — CID 43176525

IUPAC(2-hydroxyphenyl)-(3-methylpiperidin-1-yl)methanone
SMILESCC1CCCN(C(=O)c2ccccc2O)C1
InChIInChI=1S/C13H17NO2/c1-10-5-4-8-14(9-10)13(16)11-6-2-3-7-12(11)15/h2-3,6-7,10,15H,4-5,8-9H2,1H3
InChIKeyRRMSMZUDBSOARW-UHFFFAOYSA-N
MW219.28 g/mol
LogP2.26
Rot. Bonds1

About (2-hydroxyphenyl)-(3-methylpiperidin-1-yl)methanone

(2-hydroxyphenyl)-(3-methylpiperidin-1-yl)methanone (PubChem CID 43176525) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is (2-hydroxyphenyl)-(3-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(2-hydroxyphenyl)-(3-methylpiperidin-1-yl)methanone
PubChem CID43176525
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC Name(2-hydroxyphenyl)-(3-methylpiperidin-1-yl)methanone
SMILESCC1CCCN(C(=O)c2ccccc2O)C1
InChIInChI=1S/C13H17NO2/c1-10-5-4-8-14(9-10)13(16)11-6-2-3-7-12(11)15/h2-3,6-7,10,15H,4-5,8-9H2,1H3
InChIKeyRRMSMZUDBSOARW-UHFFFAOYSA-N
XLogP2.26
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2-hydroxyphenyl)-(3-methylpiperidin-1-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2-chlorophenyl)-[(3S)-3-methylpiperidin-1-yl]methanone
CID 668837
(2-bromophenyl)-(3-methylpiperidin-1-yl)methanone
CID 2842644
(3-methylpiperidin-1-yl)-naphthalen-1-ylmethanone
CID 4284306
(3-methylpiperidin-1-yl)-(2-phenylphenyl)methanone
CID 145074251
(3R)-1-(2-hydroxybenzoyl)piperidine-3-carboxylic acid
CID 30049767
[3-(hydroxymethyl)piperidin-1-yl]-(2-hydroxyphenyl)methanone
CID 43403148
(2,3-dimethylphenyl)-(3-methylpiperidin-1-yl)methanone
CID 78783803
N-[(3R)-1-(2-hydroxybenzoyl)piperidin-3-yl]-2-methylpropanamide
CID 94800761
2-[2-(3-methylpiperidine-1-carbonyl)phenyl]acetonitrile
CID 82179345
(2-fluoro-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone
CID 107358404
(3-methylpiperidin-1-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone
CID 84576155
(2-hydroxy-5-methylphenyl)-(4-methylazepan-1-yl)methanone
CID 62045285

Frequently Asked Questions

What is the IUPAC name of (2-hydroxyphenyl)-(3-methylpiperidin-1-yl)methanone?
The IUPAC name of (2-hydroxyphenyl)-(3-methylpiperidin-1-yl)methanone (CID 43176525) is (2-hydroxyphenyl)-(3-methylpiperidin-1-yl)methanone.
What is the SMILES notation for (2-hydroxyphenyl)-(3-methylpiperidin-1-yl)methanone?
The canonical SMILES for (2-hydroxyphenyl)-(3-methylpiperidin-1-yl)methanone is CC1CCCN(C(=O)c2ccccc2O)C1.
What is the InChIKey of (2-hydroxyphenyl)-(3-methylpiperidin-1-yl)methanone?
The InChIKey is RRMSMZUDBSOARW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2/c1-10-5-4-8-14(9-10)13(16)11-6-2-3-7-12(11)15/h2-3,6-7,10,15H,4-5,8-9H2,1H3.
What are the key properties of (2-hydroxyphenyl)-(3-methylpiperidin-1-yl)methanone?
(2-hydroxyphenyl)-(3-methylpiperidin-1-yl)methanone has a molecular weight of 219.28 g/mol, XLogP of 2.26, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydroxyphenyl)-(3-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 43176525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).