[5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]-[(3R)-3-methylpiperazin-1-yl]methanone

C14H19N5O2 — CID 124614105

IUPAC[5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]-[(3R)-3-methylpiperazin-1-yl]methanone
SMILESCc1oc(-c2cnn(C)c2)nc1C(=O)N1CCN[C@H](C)C1
InChIInChI=1S/C14H19N5O2/c1-9-7-19(5-4-15-9)14(20)12-10(2)21-13(17-12)11-6-16-18(3)8-11/h6,8-9,15H,4-5,7H2,1-3H3/t9-/m1/s1
InChIKeyICIFLGBQYNKAHV-SECBINFHSA-N
MW289.34 g/mol
LogP0.82
Rot. Bonds2

About [5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]-[(3R)-3-methylpiperazin-1-yl]methanone

[5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]-[(3R)-3-methylpiperazin-1-yl]methanone (PubChem CID 124614105) has the molecular formula C14H19N5O2 and a molecular weight of 289.34 g/mol. Its IUPAC name is [5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]-[(3R)-3-methylpiperazin-1-yl]methanone.

Molecular Properties

Compound Name[5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]-[(3R)-3-methylpiperazin-1-yl]methanone
PubChem CID124614105
Molecular FormulaC14H19N5O2
Molecular Weight289.34 g/mol
Exact Mass289.15
IUPAC Name[5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]-[(3R)-3-methylpiperazin-1-yl]methanone
SMILESCc1oc(-c2cnn(C)c2)nc1C(=O)N1CCN[C@H](C)C1
InChIInChI=1S/C14H19N5O2/c1-9-7-19(5-4-15-9)14(20)12-10(2)21-13(17-12)11-6-16-18(3)8-11/h6,8-9,15H,4-5,7H2,1-3H3/t9-/m1/s1
InChIKeyICIFLGBQYNKAHV-SECBINFHSA-N
XLogP0.82
TPSA76.19 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]-[(3R)-3-methylpiperazin-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

N-[(1,3-dimethylpyrazol-4-yl)methyl]-N,2,5-trimethyl-1,3-oxazole-4-carboxamide
CID 71835833
(4,4-Diethylpiperidin-1-yl)-[5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]methanone
CID 121587122
N-[1-(hydroxymethyl)cyclopropyl]-5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-4-carboxamide
CID 127712798
N-cyclobutyl-5-methyl-2-(1-methylpyrazol-4-yl)-N-(2,2,2-trifluoroethyl)-1,3-oxazole-4-carboxamide
CID 136513426
N-[(2R)-3,3-dimethylbutan-2-yl]-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-5-carboxamide
CID 138003275
N-(3-amino-2,2-difluoropropyl)-5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-4-carboxamide;hydrochloride
CID 120410918
N-(3-amino-2,2-difluoropropyl)-5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-4-carboxamide
CID 120410919
5-methyl-2-(1-methylpyrazol-4-yl)-N-(3,3,3-trifluoro-2-piperazin-1-ylpropyl)-1,3-oxazole-4-carboxamide;hydrochloride
CID 120812770
5-methyl-2-(1-methylpyrazol-4-yl)-N-(3,3,3-trifluoro-2-piperazin-1-ylpropyl)-1,3-oxazole-4-carboxamide
CID 120812771
N-(3,3-difluorocyclohexyl)-5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-4-carboxamide
CID 127600892
N-[[(2S,4S)-4-fluoro-1-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-2-yl]methyl]-5-methyl-1,3-oxazole-4-carboxamide
CID 128966330
N-(2,2-difluoropropyl)-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-5-carboxamide
CID 137980547

Frequently Asked Questions

What is the IUPAC name of [5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]-[(3R)-3-methylpiperazin-1-yl]methanone?
The IUPAC name of [5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]-[(3R)-3-methylpiperazin-1-yl]methanone (CID 124614105) is [5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]-[(3R)-3-methylpiperazin-1-yl]methanone.
What is the SMILES notation for [5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]-[(3R)-3-methylpiperazin-1-yl]methanone?
The canonical SMILES for [5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]-[(3R)-3-methylpiperazin-1-yl]methanone is Cc1oc(-c2cnn(C)c2)nc1C(=O)N1CCN[C@H](C)C1.
What is the InChIKey of [5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]-[(3R)-3-methylpiperazin-1-yl]methanone?
The InChIKey is ICIFLGBQYNKAHV-SECBINFHSA-N. The full InChI is InChI=1S/C14H19N5O2/c1-9-7-19(5-4-15-9)14(20)12-10(2)21-13(17-12)11-6-16-18(3)8-11/h6,8-9,15H,4-5,7H2,1-3H3/t9-/m1/s1.
What are the key properties of [5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]-[(3R)-3-methylpiperazin-1-yl]methanone?
[5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]-[(3R)-3-methylpiperazin-1-yl]methanone has a molecular weight of 289.34 g/mol, XLogP of 0.82, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]-[(3R)-3-methylpiperazin-1-yl]methanone is sourced from PubChem (CID 124614105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).