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

C11H10N2O3 — CID 110693653

IUPACN-(3-methoxyphenyl)-1,2-oxazole-5-carboxamide
SMILESCOc1cccc(NC(=O)c2ccno2)c1
InChIInChI=1S/C11H10N2O3/c1-15-9-4-2-3-8(7-9)13-11(14)10-5-6-12-16-10/h2-7H,1H3,(H,13,14)
InChIKeyKUKNHIOISSRQFH-UHFFFAOYSA-N
MW218.21 g/mol
LogP1.94
Rot. Bonds3

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

N-(3-methoxyphenyl)-1,2-oxazole-5-carboxamide (PubChem CID 110693653) has the molecular formula C11H10N2O3 and a molecular weight of 218.21 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-1,2-oxazole-5-carboxamide
PubChem CID110693653
Molecular FormulaC11H10N2O3
Molecular Weight218.21 g/mol
Exact Mass218.07
IUPAC NameN-(3-methoxyphenyl)-1,2-oxazole-5-carboxamide
SMILESCOc1cccc(NC(=O)c2ccno2)c1
InChIInChI=1S/C11H10N2O3/c1-15-9-4-2-3-8(7-9)13-11(14)10-5-6-12-16-10/h2-7H,1H3,(H,13,14)
InChIKeyKUKNHIOISSRQFH-UHFFFAOYSA-N
XLogP1.94
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[3-(1,2-oxazole-5-carbonylamino)phenoxy]acetate
CID 61057722
2-[3-(1,2-oxazole-5-carbonylamino)phenoxy]acetic acid
CID 55148878
N-[3-methoxy-5-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]-1,2-oxazole-5-carboxamide
CID 16745785
N-[3-(hydroxymethyl)phenyl]-1,2-oxazole-5-carboxamide
CID 60630049
5-(furan-2-yl)-N-(3-methoxyphenyl)furan-2-carboxamide
CID 71690130
3-[(3-methoxyphenyl)carbamoyl]pyrazine-2-carboxylic acid
CID 20866755
methane;N-(3-methoxyphenyl)acetamide
CID 161026095
N-(3-methoxyphenyl)-5-(4-methoxyphenyl)-1,2-oxazole-4-carboxamide
CID 110650232
6-N-(3-methoxyphenyl)-2-N-phenylpyridine-2,6-dicarboxamide
CID 109099989
2-fluoro-N-(3-methoxyphenyl)benzamide
CID 2292975
3-amino-N-(3-methoxyphenyl)pyrazine-2-carboxamide
CID 46673484
3-chloro-N-(3-methoxyphenyl)pyridine-4-carboxamide
CID 66462058

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-1,2-oxazole-5-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)-1,2-oxazole-5-carboxamide (CID 110693653) is N-(3-methoxyphenyl)-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)-1,2-oxazole-5-carboxamide is COc1cccc(NC(=O)c2ccno2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-1,2-oxazole-5-carboxamide?
The InChIKey is KUKNHIOISSRQFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O3/c1-15-9-4-2-3-8(7-9)13-11(14)10-5-6-12-16-10/h2-7H,1H3,(H,13,14).
What are the key properties of N-(3-methoxyphenyl)-1,2-oxazole-5-carboxamide?
N-(3-methoxyphenyl)-1,2-oxazole-5-carboxamide has a molecular weight of 218.21 g/mol, XLogP of 1.94, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 110693653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).