(3-hydroxy-4-methylpiperidin-1-yl)-[2-methyl-4-(methylamino)phenyl]methanone

C15H22N2O2 — CID 102964750

IUPAC(3-hydroxy-4-methylpiperidin-1-yl)-[2-methyl-4-(methylamino)phenyl]methanone
SMILESCNc1ccc(C(=O)N2CCC(C)C(O)C2)c(C)c1
InChIInChI=1S/C15H22N2O2/c1-10-6-7-17(9-14(10)18)15(19)13-5-4-12(16-3)8-11(13)2/h4-5,8,10,14,16,18H,6-7,9H2,1-3H3
InChIKeyMHLDAMNMSNRHOM-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.88
Rot. Bonds2

About (3-hydroxy-4-methylpiperidin-1-yl)-[2-methyl-4-(methylamino)phenyl]methanone

(3-hydroxy-4-methylpiperidin-1-yl)-[2-methyl-4-(methylamino)phenyl]methanone (PubChem CID 102964750) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is (3-hydroxy-4-methylpiperidin-1-yl)-[2-methyl-4-(methylamino)phenyl]methanone.

Molecular Properties

Compound Name(3-hydroxy-4-methylpiperidin-1-yl)-[2-methyl-4-(methylamino)phenyl]methanone
PubChem CID102964750
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name(3-hydroxy-4-methylpiperidin-1-yl)-[2-methyl-4-(methylamino)phenyl]methanone
SMILESCNc1ccc(C(=O)N2CCC(C)C(O)C2)c(C)c1
InChIInChI=1S/C15H22N2O2/c1-10-6-7-17(9-14(10)18)15(19)13-5-4-12(16-3)8-11(13)2/h4-5,8,10,14,16,18H,6-7,9H2,1-3H3
InChIKeyMHLDAMNMSNRHOM-UHFFFAOYSA-N
XLogP1.88
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (3-hydroxy-4-methylpiperidin-1-yl)-[2-methyl-4-(methylamino)phenyl]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-(ethylamino)-4-methylphenyl]-(3-hydroxy-4-methylpiperidin-1-yl)methanone
CID 102964719
(4-hydroxy-2-methylphenyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
CID 103863834
1-methyl-4-[2-methyl-4-(methylamino)benzoyl]-1,4-diazepan-2-one
CID 102892314
(4-chloro-2-methylphenyl)-[(3S)-3-hydroxypyrrolidin-1-yl]methanone
CID 103781423
(3-hydroxy-4-methylpiperidin-1-yl)-(2,3,4-trifluorophenyl)methanone
CID 103900375
[(3R)-3-hydroxypyrrolidin-1-yl]-(4-methoxy-2-methylphenyl)methanone
CID 111561506
(3-hydroxy-4-methylpiperidin-1-yl)-(2,4,5-trifluoro-3-hydroxyphenyl)methanone
CID 104580882
(4-bromophenyl)-(3-hydroxy-4-methylpiperidin-1-yl)methanone
CID 103901069
(4,5-dimethylthiophen-2-yl)-(3-hydroxy-4-methylpiperidin-1-yl)methanone
CID 103900652
[3-chloro-6-(methylamino)-2-pyridinyl]-(3-hydroxy-4-methylpiperidin-1-yl)methanone
CID 102964681
(2,5-dimethylphenyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
CID 66291160
(4-bromo-2-methylphenyl)-(4-hydroxypiperidin-1-yl)methanone
CID 43630038

Frequently Asked Questions

What is the IUPAC name of (3-hydroxy-4-methylpiperidin-1-yl)-[2-methyl-4-(methylamino)phenyl]methanone?
The IUPAC name of (3-hydroxy-4-methylpiperidin-1-yl)-[2-methyl-4-(methylamino)phenyl]methanone (CID 102964750) is (3-hydroxy-4-methylpiperidin-1-yl)-[2-methyl-4-(methylamino)phenyl]methanone.
What is the SMILES notation for (3-hydroxy-4-methylpiperidin-1-yl)-[2-methyl-4-(methylamino)phenyl]methanone?
The canonical SMILES for (3-hydroxy-4-methylpiperidin-1-yl)-[2-methyl-4-(methylamino)phenyl]methanone is CNc1ccc(C(=O)N2CCC(C)C(O)C2)c(C)c1.
What is the InChIKey of (3-hydroxy-4-methylpiperidin-1-yl)-[2-methyl-4-(methylamino)phenyl]methanone?
The InChIKey is MHLDAMNMSNRHOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-10-6-7-17(9-14(10)18)15(19)13-5-4-12(16-3)8-11(13)2/h4-5,8,10,14,16,18H,6-7,9H2,1-3H3.
What are the key properties of (3-hydroxy-4-methylpiperidin-1-yl)-[2-methyl-4-(methylamino)phenyl]methanone?
(3-hydroxy-4-methylpiperidin-1-yl)-[2-methyl-4-(methylamino)phenyl]methanone has a molecular weight of 262.35 g/mol, XLogP of 1.88, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-hydroxy-4-methylpiperidin-1-yl)-[2-methyl-4-(methylamino)phenyl]methanone is sourced from PubChem (CID 102964750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).