(2-methylpiperidin-1-yl)-(5-phenyl-1,2-oxazol-3-yl)methanone

C16H18N2O2 — CID 3158156

IUPAC(2-methylpiperidin-1-yl)-(5-phenyl-1,2-oxazol-3-yl)methanone
SMILESCC1CCCCN1C(=O)c1cc(-c2ccccc2)on1
InChIInChI=1S/C16H18N2O2/c1-12-7-5-6-10-18(12)16(19)14-11-15(20-17-14)13-8-3-2-4-9-13/h2-4,8-9,11-12H,5-7,10H2,1H3
InChIKeyNSLWTPGSAPJACL-UHFFFAOYSA-N
MW270.33 g/mol
LogP3.36
Rot. Bonds2

About (2-methylpiperidin-1-yl)-(5-phenyl-1,2-oxazol-3-yl)methanone

(2-methylpiperidin-1-yl)-(5-phenyl-1,2-oxazol-3-yl)methanone (PubChem CID 3158156) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is (2-methylpiperidin-1-yl)-(5-phenyl-1,2-oxazol-3-yl)methanone.

Molecular Properties

Compound Name(2-methylpiperidin-1-yl)-(5-phenyl-1,2-oxazol-3-yl)methanone
PubChem CID3158156
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name(2-methylpiperidin-1-yl)-(5-phenyl-1,2-oxazol-3-yl)methanone
SMILESCC1CCCCN1C(=O)c1cc(-c2ccccc2)on1
InChIInChI=1S/C16H18N2O2/c1-12-7-5-6-10-18(12)16(19)14-11-15(20-17-14)13-8-3-2-4-9-13/h2-4,8-9,11-12H,5-7,10H2,1H3
InChIKeyNSLWTPGSAPJACL-UHFFFAOYSA-N
XLogP3.36
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (2-methylpiperidin-1-yl)-(5-phenyl-1,2-oxazol-3-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-methylpiperidin-1-yl)-(5-pyridin-3-yl-1,2-oxazol-3-yl)methanone
CID 22427477
(2,6-dimethylpiperidin-1-yl)-(5-phenyl-1,2-oxazol-3-yl)methanone
CID 3158157
[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]-(2-methylpiperidin-1-yl)methanone
CID 5128006
[2-(4-fluorophenyl)piperidin-1-yl]-(5-phenyl-1,2-oxazol-3-yl)methanone
CID 70770427
3-(2-methylazepane-1-carbonyl)-1,2-oxazole-5-carboxylic acid
CID 107369689
[2-(hydroxymethyl)pyrrolidin-1-yl]-(5-phenyl-1,2-oxazol-3-yl)methanone
CID 61411316
(5-phenyl-1,2-oxazol-3-yl)-[(2R)-2-pyridin-3-ylpiperidin-1-yl]methanone
CID 95708141
(5-cyclopropyl-1,2-oxazol-3-yl)-(2-methylpiperidin-1-yl)methanone
CID 22427517
1-(5-phenyl-1,2-oxazole-3-carbonyl)-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-one
CID 4775686
(2S)-N-phenyl-1-(5-phenyl-1,2-oxazole-3-carbonyl)pyrrolidine-2-carboxamide
CID 30855025
(3S)-1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-3-carboxylic acid
CID 119113731
[1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]-piperidin-1-ylmethanone
CID 51264852

Frequently Asked Questions

What is the IUPAC name of (2-methylpiperidin-1-yl)-(5-phenyl-1,2-oxazol-3-yl)methanone?
The IUPAC name of (2-methylpiperidin-1-yl)-(5-phenyl-1,2-oxazol-3-yl)methanone (CID 3158156) is (2-methylpiperidin-1-yl)-(5-phenyl-1,2-oxazol-3-yl)methanone.
What is the SMILES notation for (2-methylpiperidin-1-yl)-(5-phenyl-1,2-oxazol-3-yl)methanone?
The canonical SMILES for (2-methylpiperidin-1-yl)-(5-phenyl-1,2-oxazol-3-yl)methanone is CC1CCCCN1C(=O)c1cc(-c2ccccc2)on1.
What is the InChIKey of (2-methylpiperidin-1-yl)-(5-phenyl-1,2-oxazol-3-yl)methanone?
The InChIKey is NSLWTPGSAPJACL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-12-7-5-6-10-18(12)16(19)14-11-15(20-17-14)13-8-3-2-4-9-13/h2-4,8-9,11-12H,5-7,10H2,1H3.
What are the key properties of (2-methylpiperidin-1-yl)-(5-phenyl-1,2-oxazol-3-yl)methanone?
(2-methylpiperidin-1-yl)-(5-phenyl-1,2-oxazol-3-yl)methanone has a molecular weight of 270.33 g/mol, XLogP of 3.36, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpiperidin-1-yl)-(5-phenyl-1,2-oxazol-3-yl)methanone is sourced from PubChem (CID 3158156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).