N-[(2R)-3,3-dimethylbutan-2-yl]-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-5-carboxamide

C15H22N4O2 — CID 138003275

IUPACN-[(2R)-3,3-dimethylbutan-2-yl]-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-5-carboxamide
SMILESCc1nc(-c2cnn(C)c2)oc1C(=O)N[C@H](C)C(C)(C)C
InChIInChI=1S/C15H22N4O2/c1-9-12(13(20)18-10(2)15(3,4)5)21-14(17-9)11-7-16-19(6)8-11/h7-8,10H,1-6H3,(H,18,20)/t10-/m1/s1
InChIKeyWSIUEMBWYMJEEE-SNVBAGLBSA-N
MW290.37 g/mol
LogP2.55
Rot. Bonds3

About N-[(2R)-3,3-dimethylbutan-2-yl]-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-5-carboxamide

N-[(2R)-3,3-dimethylbutan-2-yl]-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-5-carboxamide (PubChem CID 138003275) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is N-[(2R)-3,3-dimethylbutan-2-yl]-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-[(2R)-3,3-dimethylbutan-2-yl]-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-5-carboxamide
PubChem CID138003275
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC NameN-[(2R)-3,3-dimethylbutan-2-yl]-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-5-carboxamide
SMILESCc1nc(-c2cnn(C)c2)oc1C(=O)N[C@H](C)C(C)(C)C
InChIInChI=1S/C15H22N4O2/c1-9-12(13(20)18-10(2)15(3,4)5)21-14(17-9)11-7-16-19(6)8-11/h7-8,10H,1-6H3,(H,18,20)/t10-/m1/s1
InChIKeyWSIUEMBWYMJEEE-SNVBAGLBSA-N
XLogP2.55
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(2R)-3,3-dimethylbutan-2-yl]-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-5-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-3,3-dimethylbutan-2-yl]-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-5-carboxamide?
The IUPAC name of N-[(2R)-3,3-dimethylbutan-2-yl]-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-5-carboxamide (CID 138003275) is N-[(2R)-3,3-dimethylbutan-2-yl]-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-5-carboxamide.
What is the SMILES notation for N-[(2R)-3,3-dimethylbutan-2-yl]-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-5-carboxamide?
The canonical SMILES for N-[(2R)-3,3-dimethylbutan-2-yl]-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-5-carboxamide is Cc1nc(-c2cnn(C)c2)oc1C(=O)N[C@H](C)C(C)(C)C.
What is the InChIKey of N-[(2R)-3,3-dimethylbutan-2-yl]-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-5-carboxamide?
The InChIKey is WSIUEMBWYMJEEE-SNVBAGLBSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-9-12(13(20)18-10(2)15(3,4)5)21-14(17-9)11-7-16-19(6)8-11/h7-8,10H,1-6H3,(H,18,20)/t10-/m1/s1.
What are the key properties of N-[(2R)-3,3-dimethylbutan-2-yl]-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-5-carboxamide?
N-[(2R)-3,3-dimethylbutan-2-yl]-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-5-carboxamide has a molecular weight of 290.37 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-3,3-dimethylbutan-2-yl]-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 138003275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).