5-(1-ethylpyrazol-4-yl)-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-1,2-oxazole-3-carboxamide

C19H17FN6O2 — CID 46975544

IUPAC5-(1-ethylpyrazol-4-yl)-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-1,2-oxazole-3-carboxamide
SMILESCCn1cc(-c2cc(C(=O)Nc3cc(C)nn3-c3ccc(F)cc3)no2)cn1
InChIInChI=1S/C19H17FN6O2/c1-3-25-11-13(10-21-25)17-9-16(24-28-17)19(27)22-18-8-12(2)23-26(18)15-6-4-14(20)5-7-15/h4-11H,3H2,1-2H3,(H,22,27)
InChIKeyFQQLKPHBTPSGTM-UHFFFAOYSA-N
MW380.38 g/mol
LogP3.44
Rot. Bonds5

About 5-(1-ethylpyrazol-4-yl)-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-1,2-oxazole-3-carboxamide

5-(1-ethylpyrazol-4-yl)-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-1,2-oxazole-3-carboxamide (PubChem CID 46975544) has the molecular formula C19H17FN6O2 and a molecular weight of 380.38 g/mol. Its IUPAC name is 5-(1-ethylpyrazol-4-yl)-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-(1-ethylpyrazol-4-yl)-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-1,2-oxazole-3-carboxamide
PubChem CID46975544
Molecular FormulaC19H17FN6O2
Molecular Weight380.38 g/mol
Exact Mass380.14
IUPAC Name5-(1-ethylpyrazol-4-yl)-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-1,2-oxazole-3-carboxamide
SMILESCCn1cc(-c2cc(C(=O)Nc3cc(C)nn3-c3ccc(F)cc3)no2)cn1
InChIInChI=1S/C19H17FN6O2/c1-3-25-11-13(10-21-25)17-9-16(24-28-17)19(27)22-18-8-12(2)23-26(18)15-6-4-14(20)5-7-15/h4-11H,3H2,1-2H3,(H,22,27)
InChIKeyFQQLKPHBTPSGTM-UHFFFAOYSA-N
XLogP3.44
TPSA90.77 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.38
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[(1-ethylpyrazol-4-yl)methyl]-5-(4-fluorophenyl)-1,2-oxazole-3-carboxamide
CID 19290726
5-(4-chlorophenyl)-N-(5-methyl-2-phenylpyrazol-3-yl)-1,2-oxazole-3-carboxamide
CID 15988870
N-[5-(3,4-dimethylphenyl)-1-methylimidazol-2-yl]-5-(1-ethylpyrazol-4-yl)-1,2-oxazole-3-carboxamide
CID 46978814
N-[1-ethyl-3-(2-methylpropylcarbamoyl)pyrazol-4-yl]-5-(4-fluorophenyl)-1,2-oxazole-3-carboxamide
CID 19402672
N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-2-methylbutanamide
CID 45153613
N-(5-methyl-2-phenylpyrazol-3-yl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
CID 17253077
N-[5-(dimethylcarbamoyl)-1-ethylpyrazol-4-yl]-5-(4-fluorophenyl)-1,2-oxazole-3-carboxamide
CID 19339982
2-ethoxy-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]benzamide
CID 35534339
N-(2-benzyl-3H-benzimidazol-5-yl)-5-(1-ethylpyrazol-4-yl)-1,2-oxazole-3-carboxamide
CID 46975532
N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-5-(4-fluorophenyl)-1,2-oxazole-3-carboxamide
CID 95744309
N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-3-methylbenzamide
CID 112805726
N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-2-methylpentanamide
CID 112805733

Frequently Asked Questions

What is the IUPAC name of 5-(1-ethylpyrazol-4-yl)-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-(1-ethylpyrazol-4-yl)-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-1,2-oxazole-3-carboxamide (CID 46975544) is 5-(1-ethylpyrazol-4-yl)-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-(1-ethylpyrazol-4-yl)-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-(1-ethylpyrazol-4-yl)-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-1,2-oxazole-3-carboxamide is CCn1cc(-c2cc(C(=O)Nc3cc(C)nn3-c3ccc(F)cc3)no2)cn1.
What is the InChIKey of 5-(1-ethylpyrazol-4-yl)-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-1,2-oxazole-3-carboxamide?
The InChIKey is FQQLKPHBTPSGTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN6O2/c1-3-25-11-13(10-21-25)17-9-16(24-28-17)19(27)22-18-8-12(2)23-26(18)15-6-4-14(20)5-7-15/h4-11H,3H2,1-2H3,(H,22,27).
What are the key properties of 5-(1-ethylpyrazol-4-yl)-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-1,2-oxazole-3-carboxamide?
5-(1-ethylpyrazol-4-yl)-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-1,2-oxazole-3-carboxamide has a molecular weight of 380.38 g/mol, XLogP of 3.44, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-ethylpyrazol-4-yl)-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 46975544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).