3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylpropanamide

C10H16N2O2S — CID 29198709

IUPAC3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylpropanamide
SMILESCc1csc(=O)n1CCC(=O)NC(C)C
InChIInChI=1S/C10H16N2O2S/c1-7(2)11-9(13)4-5-12-8(3)6-15-10(12)14/h6-7H,4-5H2,1-3H3,(H,11,13)
InChIKeyIOCHHPLJCFDMTP-UHFFFAOYSA-N
MW228.32 g/mol
LogP1.13
Rot. Bonds4

About 3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylpropanamide

3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylpropanamide (PubChem CID 29198709) has the molecular formula C10H16N2O2S and a molecular weight of 228.32 g/mol. Its IUPAC name is 3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylpropanamide
PubChem CID29198709
Molecular FormulaC10H16N2O2S
Molecular Weight228.32 g/mol
Exact Mass228.09
IUPAC Name3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylpropanamide
SMILESCc1csc(=O)n1CCC(=O)NC(C)C
InChIInChI=1S/C10H16N2O2S/c1-7(2)11-9(13)4-5-12-8(3)6-15-10(12)14/h6-7H,4-5H2,1-3H3,(H,11,13)
InChIKeyIOCHHPLJCFDMTP-UHFFFAOYSA-N
XLogP1.13
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-amino-2,2-difluoropropyl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide;hydrochloride
CID 120408369
N-(3-amino-2,2-difluoropropyl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
CID 120408370
3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(3,3,3-trifluoro-2-piperazin-1-ylpropyl)propanamide
CID 120811257
3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2,2,2-trifluoroethyl)propanamide
CID 133865230
N-cycloheptyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
CID 4963584
3-(4,5-dimethyl-2-oxo-1,3-thiazol-3-yl)-N-(2-sulfanylethyl)propanamide
CID 177680058
N-(2,3-dihydro-1,3-thiazol-4-ylmethyl)-N-methylpropanamide
CID 129309953
2-(2-methyl-2,3-dihydro-1,3-thiazol-4-yl)-N-propan-2-ylacetamide
CID 130214752
3-[[3-oxo-3-(prop-1-en-2-ylamino)propyl]disulfanyl]-N-propan-2-ylpropanamide
CID 178093664
N-cyclooctyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
CID 16376800
2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-pentan-3-ylacetamide
CID 16384335
N-(3-methylbutan-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
CID 17402743

Frequently Asked Questions

What is the IUPAC name of 3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylpropanamide?
The IUPAC name of 3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylpropanamide (CID 29198709) is 3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylpropanamide.
What is the SMILES notation for 3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylpropanamide?
The canonical SMILES for 3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylpropanamide is Cc1csc(=O)n1CCC(=O)NC(C)C.
What is the InChIKey of 3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylpropanamide?
The InChIKey is IOCHHPLJCFDMTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2S/c1-7(2)11-9(13)4-5-12-8(3)6-15-10(12)14/h6-7H,4-5H2,1-3H3,(H,11,13).
What are the key properties of 3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylpropanamide?
3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylpropanamide has a molecular weight of 228.32 g/mol, XLogP of 1.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylpropanamide is sourced from PubChem (CID 29198709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).