N-phenyl-4,5-dihydro-1,3-thiazole-2-carboxamide

C10H10N2OS — CID 6425269

IUPACN-phenyl-4,5-dihydro-1,3-thiazole-2-carboxamide
SMILESO=C(Nc1ccccc1)C1=NCCS1
InChIInChI=1S/C10H10N2OS/c13-9(10-11-6-7-14-10)12-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,12,13)
InChIKeyMCTXZWKSDGYMBU-UHFFFAOYSA-N
MW206.27 g/mol
LogP1.77
Rot. Bonds2

About N-phenyl-4,5-dihydro-1,3-thiazole-2-carboxamide

N-phenyl-4,5-dihydro-1,3-thiazole-2-carboxamide (PubChem CID 6425269) has the molecular formula C10H10N2OS and a molecular weight of 206.27 g/mol. Its IUPAC name is N-phenyl-4,5-dihydro-1,3-thiazole-2-carboxamide.

Molecular Properties

Compound NameN-phenyl-4,5-dihydro-1,3-thiazole-2-carboxamide
PubChem CID6425269
Molecular FormulaC10H10N2OS
Molecular Weight206.27 g/mol
Exact Mass206.05
IUPAC NameN-phenyl-4,5-dihydro-1,3-thiazole-2-carboxamide
SMILESO=C(Nc1ccccc1)C1=NCCS1
InChIInChI=1S/C10H10N2OS/c13-9(10-11-6-7-14-10)12-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,12,13)
InChIKeyMCTXZWKSDGYMBU-UHFFFAOYSA-N
XLogP1.77
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4,5-dihydro-1,3-thiazol-2-ylcarbamoyl)benzoic acid
CID 2859080
N-(2-anilino-2-oxoethyl)-5-(4,5-dihydro-1,3-thiazol-2-yl)thiophene-2-carboxamide
CID 146331459
N-[2-(4,5-dihydro-1,3-thiazol-2-yl)-1-trimethylsilylethenyl]aniline
CID 139985871
2-(phenylcarbamoyl)cyclohexene-1-carboxylic acid
CID 2812906
N-phenyl-1,3-thiazole-4-carboxamide
CID 62045972
1-(4,5-dihydro-1,3-thiazol-2-yl)-2-phenylhydrazine;hydrochloride
CID 21413051
1-N,4-N-bis(4,5-dihydro-1,3-thiazol-2-yl)benzene-1,4-dicarboxamide
CID 4066059
N-(3-bromophenyl)-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzamide
CID 8713840
2-amino-N-(4,5-dihydro-1,3-thiazol-2-yl)benzamide
CID 163590328
2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-N-(2-phenylpyrimidin-5-yl)benzamide
CID 112803520
molecular hydrogen;N-phenylbenzamide
CID 145238042
3-acetamido-N-(4,5-dihydro-1,3-thiazol-2-yl)benzamide
CID 7534964

Frequently Asked Questions

What is the IUPAC name of N-phenyl-4,5-dihydro-1,3-thiazole-2-carboxamide?
The IUPAC name of N-phenyl-4,5-dihydro-1,3-thiazole-2-carboxamide (CID 6425269) is N-phenyl-4,5-dihydro-1,3-thiazole-2-carboxamide.
What is the SMILES notation for N-phenyl-4,5-dihydro-1,3-thiazole-2-carboxamide?
The canonical SMILES for N-phenyl-4,5-dihydro-1,3-thiazole-2-carboxamide is O=C(Nc1ccccc1)C1=NCCS1.
What is the InChIKey of N-phenyl-4,5-dihydro-1,3-thiazole-2-carboxamide?
The InChIKey is MCTXZWKSDGYMBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2OS/c13-9(10-11-6-7-14-10)12-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,12,13).
What are the key properties of N-phenyl-4,5-dihydro-1,3-thiazole-2-carboxamide?
N-phenyl-4,5-dihydro-1,3-thiazole-2-carboxamide has a molecular weight of 206.27 g/mol, XLogP of 1.77, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-4,5-dihydro-1,3-thiazole-2-carboxamide is sourced from PubChem (CID 6425269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).