1-ethyl-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyrazole-4-carboxamide

C15H14FN5O — CID 71921815

IUPAC1-ethyl-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyrazole-4-carboxamide
SMILESCCn1cc(C(=O)Nc2cnn(-c3ccccc3F)c2)cn1
InChIInChI=1S/C15H14FN5O/c1-2-20-9-11(7-17-20)15(22)19-12-8-18-21(10-12)14-6-4-3-5-13(14)16/h3-10H,2H2,1H3,(H,19,22)
InChIKeyULDYCGHEKMIKJL-UHFFFAOYSA-N
MW299.31 g/mol
LogP2.48
Rot. Bonds4

About 1-ethyl-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyrazole-4-carboxamide

1-ethyl-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyrazole-4-carboxamide (PubChem CID 71921815) has the molecular formula C15H14FN5O and a molecular weight of 299.31 g/mol. Its IUPAC name is 1-ethyl-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyrazole-4-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyrazole-4-carboxamide
PubChem CID71921815
Molecular FormulaC15H14FN5O
Molecular Weight299.31 g/mol
Exact Mass299.12
IUPAC Name1-ethyl-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyrazole-4-carboxamide
SMILESCCn1cc(C(=O)Nc2cnn(-c3ccccc3F)c2)cn1
InChIInChI=1S/C15H14FN5O/c1-2-20-9-11(7-17-20)15(22)19-12-8-18-21(10-12)14-6-4-3-5-13(14)16/h3-10H,2H2,1H3,(H,19,22)
InChIKeyULDYCGHEKMIKJL-UHFFFAOYSA-N
XLogP2.48
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.31
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,5-difluorophenyl)-1-(2-fluorophenyl)pyrazole-4-carboxamide
CID 94828526
N-(1-benzylpyrazol-4-yl)-1-ethylpyrazole-4-carboxamide
CID 19395795
N-[1-(2-fluorophenyl)pyrazol-4-yl]-6-oxo-1H-pyridine-3-carboxamide
CID 75378606
5-fluoro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-2-carboxamide
CID 99821177
1-ethyl-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]pyrazole-4-carboxamide
CID 19280974
1-[1-(2-fluorophenyl)pyrazol-4-yl]propan-1-one
CID 134608302
1-(2-fluorophenyl)-N-[4-(methylsulfamoyl)phenyl]pyrazole-4-carboxamide
CID 95348121
2-[4-[(1-ethylpyrazol-4-yl)carbamoyl]pyrazol-1-yl]acetic acid
CID 19500808
1-(2-fluorophenyl)-N-(3-hydroxy-4-methylpentyl)pyrazole-4-carboxamide
CID 111460687
2-amino-6-chloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-4-carboxamide
CID 166234236
N-[(2S)-1-(ethylamino)-1-oxopropan-2-yl]-1-(2-fluorophenyl)pyrazole-4-carboxamide
CID 94828484
4-amino-N-(1-ethylpyrazol-4-yl)benzamide
CID 43543193

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyrazole-4-carboxamide?
The IUPAC name of 1-ethyl-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyrazole-4-carboxamide (CID 71921815) is 1-ethyl-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyrazole-4-carboxamide.
What is the SMILES notation for 1-ethyl-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyrazole-4-carboxamide?
The canonical SMILES for 1-ethyl-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyrazole-4-carboxamide is CCn1cc(C(=O)Nc2cnn(-c3ccccc3F)c2)cn1.
What is the InChIKey of 1-ethyl-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyrazole-4-carboxamide?
The InChIKey is ULDYCGHEKMIKJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN5O/c1-2-20-9-11(7-17-20)15(22)19-12-8-18-21(10-12)14-6-4-3-5-13(14)16/h3-10H,2H2,1H3,(H,19,22).
What are the key properties of 1-ethyl-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyrazole-4-carboxamide?
1-ethyl-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyrazole-4-carboxamide has a molecular weight of 299.31 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyrazole-4-carboxamide is sourced from PubChem (CID 71921815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).