methane;N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,3-oxazole-5-carboxamide

C15H15N3O2S — CID 159351221

IUPACmethane;N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,3-oxazole-5-carboxamide
SMILESC.Cc1ccc(-c2csc(NC(=O)c3cnco3)n2)cc1
InChIInChI=1S/C14H11N3O2S.CH4/c1-9-2-4-10(5-3-9)11-7-20-14(16-11)17-13(18)12-6-15-8-19-12;/h2-8H,1H3,(H,16,17,18);1H4
InChIKeyLHISUUNEVHWTEU-UHFFFAOYSA-N
MW301.37 g/mol
LogP3.99
Rot. Bonds3

About methane;N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,3-oxazole-5-carboxamide

methane;N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,3-oxazole-5-carboxamide (PubChem CID 159351221) has the molecular formula C15H15N3O2S and a molecular weight of 301.37 g/mol. Its IUPAC name is methane;N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound Namemethane;N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,3-oxazole-5-carboxamide
PubChem CID159351221
Molecular FormulaC15H15N3O2S
Molecular Weight301.37 g/mol
Exact Mass301.09
IUPAC Namemethane;N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,3-oxazole-5-carboxamide
SMILESC.Cc1ccc(-c2csc(NC(=O)c3cnco3)n2)cc1
InChIInChI=1S/C14H11N3O2S.CH4/c1-9-2-4-10(5-3-9)11-7-20-14(16-11)17-13(18)12-6-15-8-19-12;/h2-8H,1H3,(H,16,17,18);1H4
InChIKeyLHISUUNEVHWTEU-UHFFFAOYSA-N
XLogP3.99
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.37
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,2-oxazole-5-carboxamide
CID 2999703
N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,2-oxazole-3-carboxamide
CID 153338934
5-methyl-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,2-oxazole-3-carboxamide
CID 16953644
N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide
CID 16619036
ethane;N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide
CID 153338927
3,5-dichloro-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]benzamide
CID 2562898
2-(4-methylphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide
CID 43951124
trans-(1S,2S)-2-methyl-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]cyclopropane-1-carboxamide
CID 2449771
N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]furan-2-carboxamide
CID 4061506
4-methyl-N-[4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]benzamide
CID 5019698
N-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-4-methylbenzamide
CID 721661
2,5-difluoro-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]benzamide
CID 46667765

Frequently Asked Questions

What is the IUPAC name of methane;N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,3-oxazole-5-carboxamide?
The IUPAC name of methane;N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,3-oxazole-5-carboxamide (CID 159351221) is methane;N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,3-oxazole-5-carboxamide.
What is the SMILES notation for methane;N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,3-oxazole-5-carboxamide?
The canonical SMILES for methane;N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,3-oxazole-5-carboxamide is C.Cc1ccc(-c2csc(NC(=O)c3cnco3)n2)cc1.
What is the InChIKey of methane;N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,3-oxazole-5-carboxamide?
The InChIKey is LHISUUNEVHWTEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O2S.CH4/c1-9-2-4-10(5-3-9)11-7-20-14(16-11)17-13(18)12-6-15-8-19-12;/h2-8H,1H3,(H,16,17,18);1H4.
What are the key properties of methane;N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,3-oxazole-5-carboxamide?
methane;N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,3-oxazole-5-carboxamide has a molecular weight of 301.37 g/mol, XLogP of 3.99, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methane;N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 159351221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).