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

C12H11ClN2O3 — CID 30402806

IUPACN-(5-chloro-2-methoxyphenyl)-2-methyl-1,3-oxazole-4-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1coc(C)n1
InChIInChI=1S/C12H11ClN2O3/c1-7-14-10(6-18-7)12(16)15-9-5-8(13)3-4-11(9)17-2/h3-6H,1-2H3,(H,15,16)
InChIKeySFPNMPXIOPYMID-UHFFFAOYSA-N
MW266.68 g/mol
LogP2.90
Rot. Bonds3

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

N-(5-chloro-2-methoxyphenyl)-2-methyl-1,3-oxazole-4-carboxamide (PubChem CID 30402806) has the molecular formula C12H11ClN2O3 and a molecular weight of 266.68 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-2-methyl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-2-methyl-1,3-oxazole-4-carboxamide
PubChem CID30402806
Molecular FormulaC12H11ClN2O3
Molecular Weight266.68 g/mol
Exact Mass266.05
IUPAC NameN-(5-chloro-2-methoxyphenyl)-2-methyl-1,3-oxazole-4-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1coc(C)n1
InChIInChI=1S/C12H11ClN2O3/c1-7-14-10(6-18-7)12(16)15-9-5-8(13)3-4-11(9)17-2/h3-6H,1-2H3,(H,15,16)
InChIKeySFPNMPXIOPYMID-UHFFFAOYSA-N
XLogP2.90
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.68
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-chloro-2-methoxyphenyl)-2-(thiophene-3-carbonylamino)-1,3-oxazole-4-carboxamide
CID 71788377
N-(5-chloro-2-methoxyphenyl)-6-fluoropyridine-2-carboxamide
CID 113323350
5-chloro-N-(5-chloro-2-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
CID 80625735
6-N-(5-chloro-2-methoxyphenyl)-2-N-phenylpyridine-2,6-dicarboxamide
CID 109099986
N-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide
CID 2111763
N-(5-chloro-2-methoxyphenyl)-4-methyl-1,2-oxazole-5-carboxamide
CID 110859594
N-(2-benzoyl-4-chlorophenyl)-2-methyl-1,3-oxazole-4-carboxamide
CID 30402995
5-amino-N-(5-chloro-2-methoxyphenyl)pyridine-2-carboxamide
CID 81319684
3-N,5-N-bis(5-chloro-2-methoxyphenyl)-1-methylpyrazole-3,5-dicarboxamide
CID 29097288
N-(5-chloro-2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 17394074
N-(5-chloro-2-methoxyphenyl)-3-methoxy-1,2-oxazole-5-carboxamide
CID 71802469
N-(5-chloro-2-methoxyphenyl)-6-methoxyquinoline-2-carboxamide
CID 33314112

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-methyl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-methyl-1,3-oxazole-4-carboxamide (CID 30402806) is N-(5-chloro-2-methoxyphenyl)-2-methyl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-2-methyl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-2-methyl-1,3-oxazole-4-carboxamide is COc1ccc(Cl)cc1NC(=O)c1coc(C)n1.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-2-methyl-1,3-oxazole-4-carboxamide?
The InChIKey is SFPNMPXIOPYMID-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2O3/c1-7-14-10(6-18-7)12(16)15-9-5-8(13)3-4-11(9)17-2/h3-6H,1-2H3,(H,15,16).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-2-methyl-1,3-oxazole-4-carboxamide?
N-(5-chloro-2-methoxyphenyl)-2-methyl-1,3-oxazole-4-carboxamide has a molecular weight of 266.68 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-2-methyl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 30402806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).