4-methyl-N-[(2-methylpropan-2-yl)oxy]-1,3-thiazole-5-carboxamide

C9H14N2O2S — CID 82723283

IUPAC4-methyl-N-[(2-methylpropan-2-yl)oxy]-1,3-thiazole-5-carboxamide
SMILESCc1ncsc1C(=O)NOC(C)(C)C
InChIInChI=1S/C9H14N2O2S/c1-6-7(14-5-10-6)8(12)11-13-9(2,3)4/h5H,1-4H3,(H,11,12)
InChIKeyUNYXIYQRDKDANS-UHFFFAOYSA-N
MW214.29 g/mol
LogP1.91
Rot. Bonds2

About 4-methyl-N-[(2-methylpropan-2-yl)oxy]-1,3-thiazole-5-carboxamide

4-methyl-N-[(2-methylpropan-2-yl)oxy]-1,3-thiazole-5-carboxamide (PubChem CID 82723283) has the molecular formula C9H14N2O2S and a molecular weight of 214.29 g/mol. Its IUPAC name is 4-methyl-N-[(2-methylpropan-2-yl)oxy]-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-methyl-N-[(2-methylpropan-2-yl)oxy]-1,3-thiazole-5-carboxamide
PubChem CID82723283
Molecular FormulaC9H14N2O2S
Molecular Weight214.29 g/mol
Exact Mass214.08
IUPAC Name4-methyl-N-[(2-methylpropan-2-yl)oxy]-1,3-thiazole-5-carboxamide
SMILESCc1ncsc1C(=O)NOC(C)(C)C
InChIInChI=1S/C9H14N2O2S/c1-6-7(14-5-10-6)8(12)11-13-9(2,3)4/h5H,1-4H3,(H,11,12)
InChIKeyUNYXIYQRDKDANS-UHFFFAOYSA-N
XLogP1.91
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.29
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-methyl-N-[(2-methylpropan-2-yl)oxy]-1,3-thiazole-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-(2-amino-2-methylpropyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 81482463
N-(1-hydroxy-2-methylbutan-2-yl)-4-methyl-1,3-thiazole-5-carboxamide
CID 64555805
N-(1-amino-2-methyl-1-sulfanylidenepropan-2-yl)-4-methyl-1,3-thiazole-5-carboxamide
CID 61119636
N-(2-amino-2-ethylbutyl)-4-methyl-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119639748
N-(1-bromo-3-methylpentan-3-yl)-4-methyl-1,3-thiazole-5-carboxamide
CID 106169527
3-methyl-3-[(4-methyl-1,3-thiazole-5-carbonyl)amino]butanoic acid
CID 64673287
N-(3-aminobutan-2-yl)-4-methyl-1,3-thiazole-5-carboxamide
CID 130948721
N-(2,3-dihydroxy-2-methylpropyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 66168769
(2S)-4-[(2-methylpropan-2-yl)oxy]-2-[(4-methyl-1,3-thiazole-5-carbonyl)amino]-4-oxobutanoic acid
CID 82813726
ethyl 4-[(2-methylpropan-2-yl)oxycarbamoylamino]-1,3-thiazole-5-carboxylate
CID 163365916
N-(2-amino-2-sulfanylideneethyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 61126703
N-(cyclopropylmethyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 126987991

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(2-methylpropan-2-yl)oxy]-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-methyl-N-[(2-methylpropan-2-yl)oxy]-1,3-thiazole-5-carboxamide (CID 82723283) is 4-methyl-N-[(2-methylpropan-2-yl)oxy]-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-methyl-N-[(2-methylpropan-2-yl)oxy]-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-methyl-N-[(2-methylpropan-2-yl)oxy]-1,3-thiazole-5-carboxamide is Cc1ncsc1C(=O)NOC(C)(C)C.
What is the InChIKey of 4-methyl-N-[(2-methylpropan-2-yl)oxy]-1,3-thiazole-5-carboxamide?
The InChIKey is UNYXIYQRDKDANS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2S/c1-6-7(14-5-10-6)8(12)11-13-9(2,3)4/h5H,1-4H3,(H,11,12).
What are the key properties of 4-methyl-N-[(2-methylpropan-2-yl)oxy]-1,3-thiazole-5-carboxamide?
4-methyl-N-[(2-methylpropan-2-yl)oxy]-1,3-thiazole-5-carboxamide has a molecular weight of 214.29 g/mol, XLogP of 1.91, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(2-methylpropan-2-yl)oxy]-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 82723283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).