N-(3-chloro-2-methylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide

C15H11ClN2O3 — CID 17253051

IUPACN-(3-chloro-2-methylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
SMILESCc1c(Cl)cccc1NC(=O)c1cc(-c2ccco2)on1
InChIInChI=1S/C15H11ClN2O3/c1-9-10(16)4-2-5-11(9)17-15(19)12-8-14(21-18-12)13-6-3-7-20-13/h2-8H,1H3,(H,17,19)
InChIKeyFXRZKSCRXGWEBR-UHFFFAOYSA-N
MW302.72 g/mol
LogP4.15
Rot. Bonds3

About N-(3-chloro-2-methylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide

N-(3-chloro-2-methylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide (PubChem CID 17253051) has the molecular formula C15H11ClN2O3 and a molecular weight of 302.72 g/mol. Its IUPAC name is N-(3-chloro-2-methylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-2-methylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
PubChem CID17253051
Molecular FormulaC15H11ClN2O3
Molecular Weight302.72 g/mol
Exact Mass302.05
IUPAC NameN-(3-chloro-2-methylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
SMILESCc1c(Cl)cccc1NC(=O)c1cc(-c2ccco2)on1
InChIInChI=1S/C15H11ClN2O3/c1-9-10(16)4-2-5-11(9)17-15(19)12-8-14(21-18-12)13-6-3-7-20-13/h2-8H,1H3,(H,17,19)
InChIKeyFXRZKSCRXGWEBR-UHFFFAOYSA-N
XLogP4.15
TPSA68.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.72
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(furan-2-yl)-N-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide
CID 16188844
N-(3-chlorophenyl)-5-(2-furyl)-3-isoxazolecarboxamide
CID 17253048
N-(2,5-dichlorophenyl)(5-(2-furyl)isoxazol-3-yl)carboxamide
CID 3625504
N-(5-chloro-2-hydroxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 4445460
N-(3-chlorophenyl)-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide
CID 5016616
N-(3-acetylphenyl)-5-(2-furyl)-3-isoxazolecarboxamide
CID 17253055
N-(2,4-difluorophenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 3238209
N-benzyl-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 3241359
N-(3,4-dimethylphenyl)-5-(2-furanyl)-3-isoxazolecarboxamide
CID 3244522
5-(furan-2-yl)-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide
CID 3245765
N-(5-chloro-2-methoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 6619078
N-(3-chloro-4-fluorophenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 4179895

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-methylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(3-chloro-2-methylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide (CID 17253051) is N-(3-chloro-2-methylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(3-chloro-2-methylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(3-chloro-2-methylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide is Cc1c(Cl)cccc1NC(=O)c1cc(-c2ccco2)on1.
What is the InChIKey of N-(3-chloro-2-methylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?
The InChIKey is FXRZKSCRXGWEBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2O3/c1-9-10(16)4-2-5-11(9)17-15(19)12-8-14(21-18-12)13-6-3-7-20-13/h2-8H,1H3,(H,17,19).
What are the key properties of N-(3-chloro-2-methylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?
N-(3-chloro-2-methylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide has a molecular weight of 302.72 g/mol, XLogP of 4.15, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-methylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 17253051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).