1-(5-methyl-1,2-oxazol-3-yl)-3-[(3S)-1-propan-2-ylpiperidin-3-yl]propan-2-one

C15H24N2O2 — CID 159657739

IUPAC1-(5-methyl-1,2-oxazol-3-yl)-3-[(3S)-1-propan-2-ylpiperidin-3-yl]propan-2-one
SMILESCc1cc(CC(=O)C[C@@H]2CCCN(C(C)C)C2)no1
InChIInChI=1S/C15H24N2O2/c1-11(2)17-6-4-5-13(10-17)8-15(18)9-14-7-12(3)19-16-14/h7,11,13H,4-6,8-10H2,1-3H3/t13-/m0/s1
InChIKeyMSJWFYVETRPQEF-ZDUSSCGKSA-N
MW264.37 g/mol
LogP2.61
Rot. Bonds5

About 1-(5-methyl-1,2-oxazol-3-yl)-3-[(3S)-1-propan-2-ylpiperidin-3-yl]propan-2-one

1-(5-methyl-1,2-oxazol-3-yl)-3-[(3S)-1-propan-2-ylpiperidin-3-yl]propan-2-one (PubChem CID 159657739) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-(5-methyl-1,2-oxazol-3-yl)-3-[(3S)-1-propan-2-ylpiperidin-3-yl]propan-2-one.

Molecular Properties

Compound Name1-(5-methyl-1,2-oxazol-3-yl)-3-[(3S)-1-propan-2-ylpiperidin-3-yl]propan-2-one
PubChem CID159657739
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name1-(5-methyl-1,2-oxazol-3-yl)-3-[(3S)-1-propan-2-ylpiperidin-3-yl]propan-2-one
SMILESCc1cc(CC(=O)C[C@@H]2CCCN(C(C)C)C2)no1
InChIInChI=1S/C15H24N2O2/c1-11(2)17-6-4-5-13(10-17)8-15(18)9-14-7-12(3)19-16-14/h7,11,13H,4-6,8-10H2,1-3H3/t13-/m0/s1
InChIKeyMSJWFYVETRPQEF-ZDUSSCGKSA-N
XLogP2.61
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-(5-methyl-1,2-oxazol-3-yl)-3-[(3S)-1-propan-2-ylpiperidin-3-yl]propan-2-one with MolForge

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Related Compounds

1-(3-chloro-4-methylphenyl)-3-[(3S)-1-propan-2-ylpiperidin-3-yl]propan-2-one
CID 158555474
[5-[(1-propan-2-ylpiperidin-3-yl)methyl]-1,2-oxazol-3-yl]methanol
CID 115094198
1-(1,5-dimethylpyrazol-3-yl)-2-[(3S)-1-propan-2-ylpiperidin-3-yl]ethanone
CID 159297016
ethyl 4-methyl-2-[2-oxo-3-[(3S)-1-propan-2-ylpiperidin-3-yl]propyl]-1,3-thiazole-5-carboxylate
CID 148956031
2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]acetamide
CID 52515411
2-(3,5-dimethylpyrazol-1-yl)-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]acetamide
CID 95220651
N-[(2R)-1-cyclohexylpropan-2-yl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 99838867
1-[3,5-bis(methylsulfonyl)phenyl]-2-[(3S)-1-propan-2-ylpiperidin-3-yl]ethanone
CID 146861924
2-(5-methyl-1,2-oxazol-3-yl)-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]acetamide
CID 110621001
N,2-dimethyl-6-[[(3S)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-4-carboxamide
CID 124983622
methyl 3-[(1-propan-2-ylpiperidin-3-yl)methyl]but-3-enoate
CID 117268756
(2R)-N-(cyclohexylmethyl)-2-[(S)-(5-methyl-1,2-oxazol-3-yl)methylsulfinyl]propanamide
CID 95599700

Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-1,2-oxazol-3-yl)-3-[(3S)-1-propan-2-ylpiperidin-3-yl]propan-2-one?
The IUPAC name of 1-(5-methyl-1,2-oxazol-3-yl)-3-[(3S)-1-propan-2-ylpiperidin-3-yl]propan-2-one (CID 159657739) is 1-(5-methyl-1,2-oxazol-3-yl)-3-[(3S)-1-propan-2-ylpiperidin-3-yl]propan-2-one.
What is the SMILES notation for 1-(5-methyl-1,2-oxazol-3-yl)-3-[(3S)-1-propan-2-ylpiperidin-3-yl]propan-2-one?
The canonical SMILES for 1-(5-methyl-1,2-oxazol-3-yl)-3-[(3S)-1-propan-2-ylpiperidin-3-yl]propan-2-one is Cc1cc(CC(=O)C[C@@H]2CCCN(C(C)C)C2)no1.
What is the InChIKey of 1-(5-methyl-1,2-oxazol-3-yl)-3-[(3S)-1-propan-2-ylpiperidin-3-yl]propan-2-one?
The InChIKey is MSJWFYVETRPQEF-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(2)17-6-4-5-13(10-17)8-15(18)9-14-7-12(3)19-16-14/h7,11,13H,4-6,8-10H2,1-3H3/t13-/m0/s1.
What are the key properties of 1-(5-methyl-1,2-oxazol-3-yl)-3-[(3S)-1-propan-2-ylpiperidin-3-yl]propan-2-one?
1-(5-methyl-1,2-oxazol-3-yl)-3-[(3S)-1-propan-2-ylpiperidin-3-yl]propan-2-one has a molecular weight of 264.37 g/mol, XLogP of 2.61, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-1,2-oxazol-3-yl)-3-[(3S)-1-propan-2-ylpiperidin-3-yl]propan-2-one is sourced from PubChem (CID 159657739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).