N-(2,5-dichlorophenyl)-4-methyl-1,2-oxazole-3-carboxamide

C11H8Cl2N2O2 — CID 110864101

IUPACN-(2,5-dichlorophenyl)-4-methyl-1,2-oxazole-3-carboxamide
SMILESCc1conc1C(=O)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C11H8Cl2N2O2/c1-6-5-17-15-10(6)11(16)14-9-4-7(12)2-3-8(9)13/h2-5H,1H3,(H,14,16)
InChIKeyWURYDTADDYJORT-UHFFFAOYSA-N
MW271.10 g/mol
LogP3.54
Rot. Bonds2

About N-(2,5-dichlorophenyl)-4-methyl-1,2-oxazole-3-carboxamide

N-(2,5-dichlorophenyl)-4-methyl-1,2-oxazole-3-carboxamide (PubChem CID 110864101) has the molecular formula C11H8Cl2N2O2 and a molecular weight of 271.10 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-4-methyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-4-methyl-1,2-oxazole-3-carboxamide
PubChem CID110864101
Molecular FormulaC11H8Cl2N2O2
Molecular Weight271.10 g/mol
Exact Mass270.00
IUPAC NameN-(2,5-dichlorophenyl)-4-methyl-1,2-oxazole-3-carboxamide
SMILESCc1conc1C(=O)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C11H8Cl2N2O2/c1-6-5-17-15-10(6)11(16)14-9-4-7(12)2-3-8(9)13/h2-5H,1H3,(H,14,16)
InChIKeyWURYDTADDYJORT-UHFFFAOYSA-N
XLogP3.54
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.10
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,5-dichlorophenyl)-4-methyl-1,2,5-oxadiazole-3-carboxamide
CID 110692026
N-(2,5-dichlorophenyl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
CID 5307719
N-(2,5-dichlorophenyl)-2,6-dimethylpyrimidine-4-carboxamide
CID 110864118
2-N,6-N-bis(2,5-dichlorophenyl)pyridine-2,6-dicarboxamide
CID 4104861
N-(2,5-dichlorophenyl)-2-fluoro-3-methylbenzamide
CID 80717854
2-amino-4-chloro-N-(2,5-dichlorophenyl)benzamide
CID 29037738
N-(5-chloro-2-methylphenyl)-3-phenyl-1,2-oxazole-4-carboxamide
CID 100771839
4-methyl-N-(2-propan-2-yloxyphenyl)-1,2-oxazole-3-carboxamide
CID 110860342
N-(2,5-dichlorophenyl)-1,5-dimethylpyrazole-4-carboxamide
CID 110864104
1-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-N-(2,5-dichlorophenyl)-5-methyltriazole-4-carboxamide
CID 53335370
N-(2,5-dichlorophenyl)benzamide;hydroiodide
CID 175991469
4-bromo-N-(2,5-dichlorophenyl)-1-ethylpyrazole-3-carboxamide
CID 1210310

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-4-methyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(2,5-dichlorophenyl)-4-methyl-1,2-oxazole-3-carboxamide (CID 110864101) is N-(2,5-dichlorophenyl)-4-methyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)-4-methyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(2,5-dichlorophenyl)-4-methyl-1,2-oxazole-3-carboxamide is Cc1conc1C(=O)Nc1cc(Cl)ccc1Cl.
What is the InChIKey of N-(2,5-dichlorophenyl)-4-methyl-1,2-oxazole-3-carboxamide?
The InChIKey is WURYDTADDYJORT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Cl2N2O2/c1-6-5-17-15-10(6)11(16)14-9-4-7(12)2-3-8(9)13/h2-5H,1H3,(H,14,16).
What are the key properties of N-(2,5-dichlorophenyl)-4-methyl-1,2-oxazole-3-carboxamide?
N-(2,5-dichlorophenyl)-4-methyl-1,2-oxazole-3-carboxamide has a molecular weight of 271.10 g/mol, XLogP of 3.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-4-methyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 110864101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).