4-methyl-N,2-di(propan-2-yl)-1,3-oxazole-5-carboxamide

C11H18N2O2 — CID 177272244

IUPAC4-methyl-N,2-di(propan-2-yl)-1,3-oxazole-5-carboxamide
SMILESCc1nc(C(C)C)oc1C(=O)NC(C)C
InChIInChI=1S/C11H18N2O2/c1-6(2)11-13-8(5)9(15-11)10(14)12-7(3)4/h6-7H,1-5H3,(H,12,14)
InChIKeyXRHHDTVENCHIFV-UHFFFAOYSA-N
MW210.28 g/mol
LogP2.24
Rot. Bonds3

About 4-methyl-N,2-di(propan-2-yl)-1,3-oxazole-5-carboxamide

4-methyl-N,2-di(propan-2-yl)-1,3-oxazole-5-carboxamide (PubChem CID 177272244) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 4-methyl-N,2-di(propan-2-yl)-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound Name4-methyl-N,2-di(propan-2-yl)-1,3-oxazole-5-carboxamide
PubChem CID177272244
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name4-methyl-N,2-di(propan-2-yl)-1,3-oxazole-5-carboxamide
SMILESCc1nc(C(C)C)oc1C(=O)NC(C)C
InChIInChI=1S/C11H18N2O2/c1-6(2)11-13-8(5)9(15-11)10(14)12-7(3)4/h6-7H,1-5H3,(H,12,14)
InChIKeyXRHHDTVENCHIFV-UHFFFAOYSA-N
XLogP2.24
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-methyl-N,2-di(propan-2-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

Related Compounds

N,4-dimethyl-2-propan-2-yl-1,3-oxazole-5-carboxamide
CID 130662850
3-[(2-cyclopropyl-4-methyl-1,3-oxazole-5-carbonyl)amino]butanoic acid
CID 120522817
N-(1-chloropropan-2-yl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 114299594
4-cyclopropyl-2-propan-2-yl-1,3-oxazole-5-carboxylic acid
CID 82400587
N-[(1R)-1-cyclobutylethyl]-2-(cyclopropylmethyl)-4-methyl-1,3-oxazole-5-carboxamide
CID 124843351
N-[1-(1-amino-1-oxobutan-2-yl)pyrrolidin-3-yl]-4-methyl-2-propan-2-yl-1,3-oxazole-5-carboxamide
CID 166380246
N-(5-chloropentan-2-yl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 114305863
methyl 4-(methoxymethyl)-2-propan-2-yl-1,3-oxazole-5-carboxylate
CID 114371759
N-(1-chloro-4-methylpentan-2-yl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 114300930
(2S)-2-[(2,4-dimethyl-1,3-oxazole-5-carbonyl)amino]-3,3-dimethylbutanoic acid
CID 81362291
N-(2-chloropropyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 114296555
2-methoxy-N,4-dimethyl-1,3-oxazole-5-carboxamide
CID 91511804

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N,2-di(propan-2-yl)-1,3-oxazole-5-carboxamide?
The IUPAC name of 4-methyl-N,2-di(propan-2-yl)-1,3-oxazole-5-carboxamide (CID 177272244) is 4-methyl-N,2-di(propan-2-yl)-1,3-oxazole-5-carboxamide.
What is the SMILES notation for 4-methyl-N,2-di(propan-2-yl)-1,3-oxazole-5-carboxamide?
The canonical SMILES for 4-methyl-N,2-di(propan-2-yl)-1,3-oxazole-5-carboxamide is Cc1nc(C(C)C)oc1C(=O)NC(C)C.
What is the InChIKey of 4-methyl-N,2-di(propan-2-yl)-1,3-oxazole-5-carboxamide?
The InChIKey is XRHHDTVENCHIFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-6(2)11-13-8(5)9(15-11)10(14)12-7(3)4/h6-7H,1-5H3,(H,12,14).
What are the key properties of 4-methyl-N,2-di(propan-2-yl)-1,3-oxazole-5-carboxamide?
4-methyl-N,2-di(propan-2-yl)-1,3-oxazole-5-carboxamide has a molecular weight of 210.28 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N,2-di(propan-2-yl)-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 177272244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).