2-cyclopent-2-en-1-yl-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]acetamide

C15H22N2OS — CID 56793632

IUPAC2-cyclopent-2-en-1-yl-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]acetamide
SMILESCc1nc(C(C)(C)NC(=O)CC2C=CCC2)sc1C
InChIInChI=1S/C15H22N2OS/c1-10-11(2)19-14(16-10)15(3,4)17-13(18)9-12-7-5-6-8-12/h5,7,12H,6,8-9H2,1-4H3,(H,17,18)
InChIKeyKBHQMISIFSVSFT-UHFFFAOYSA-N
MW278.42 g/mol
LogP3.47
Rot. Bonds4

About 2-cyclopent-2-en-1-yl-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]acetamide

2-cyclopent-2-en-1-yl-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]acetamide (PubChem CID 56793632) has the molecular formula C15H22N2OS and a molecular weight of 278.42 g/mol. Its IUPAC name is 2-cyclopent-2-en-1-yl-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]acetamide.

Molecular Properties

Compound Name2-cyclopent-2-en-1-yl-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]acetamide
PubChem CID56793632
Molecular FormulaC15H22N2OS
Molecular Weight278.42 g/mol
Exact Mass278.15
IUPAC Name2-cyclopent-2-en-1-yl-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]acetamide
SMILESCc1nc(C(C)(C)NC(=O)CC2C=CCC2)sc1C
InChIInChI=1S/C15H22N2OS/c1-10-11(2)19-14(16-10)15(3,4)17-13(18)9-12-7-5-6-8-12/h5,7,12H,6,8-9H2,1-4H3,(H,17,18)
InChIKeyKBHQMISIFSVSFT-UHFFFAOYSA-N
XLogP3.47
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.42
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]-2-thiomorpholin-3-ylacetamide;dihydrochloride
CID 119942290
3-amino-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]propanamide;dihydrochloride
CID 119890095
methyl 2-[(2-cyclopent-2-en-1-ylacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylate
CID 47113764
4-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-ylcarbamoyl]cyclohexane-1-carboxylic acid
CID 120673743
N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]-4-(methylamino)butanamide
CID 119890059
N'-[2-[(1S)-cyclopent-2-en-1-yl]acetyl]-4-methyl-2-phenyl-1,3-thiazole-5-carbohydrazide
CID 9160970
2-cyclopent-2-en-1-yl-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide
CID 105058863
2-[(1S)-cyclopent-2-en-1-yl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
CID 26192949
N-(1-amino-2,3-dimethylbutan-2-yl)-2-cyclopent-2-en-1-ylacetamide
CID 115310441
4-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-ylcarbamoyl]benzoic acid
CID 119185819
2-cyclopent-2-en-1-yl-N-[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]acetamide
CID 24621135
2-[(1R)-cyclopent-2-en-1-yl]-N-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]acetamide
CID 95314375

Frequently Asked Questions

What is the IUPAC name of 2-cyclopent-2-en-1-yl-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]acetamide?
The IUPAC name of 2-cyclopent-2-en-1-yl-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]acetamide (CID 56793632) is 2-cyclopent-2-en-1-yl-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]acetamide.
What is the SMILES notation for 2-cyclopent-2-en-1-yl-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]acetamide?
The canonical SMILES for 2-cyclopent-2-en-1-yl-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]acetamide is Cc1nc(C(C)(C)NC(=O)CC2C=CCC2)sc1C.
What is the InChIKey of 2-cyclopent-2-en-1-yl-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]acetamide?
The InChIKey is KBHQMISIFSVSFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2OS/c1-10-11(2)19-14(16-10)15(3,4)17-13(18)9-12-7-5-6-8-12/h5,7,12H,6,8-9H2,1-4H3,(H,17,18).
What are the key properties of 2-cyclopent-2-en-1-yl-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]acetamide?
2-cyclopent-2-en-1-yl-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]acetamide has a molecular weight of 278.42 g/mol, XLogP of 3.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopent-2-en-1-yl-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]acetamide is sourced from PubChem (CID 56793632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).