N-[1-(2-fluorophenyl)pyrazol-4-yl]-4-pyridin-2-ylbutanamide

C18H17FN4O — CID 71856417

IUPACN-[1-(2-fluorophenyl)pyrazol-4-yl]-4-pyridin-2-ylbutanamide
SMILESO=C(CCCc1ccccn1)Nc1cnn(-c2ccccc2F)c1
InChIInChI=1S/C18H17FN4O/c19-16-8-1-2-9-17(16)23-13-15(12-21-23)22-18(24)10-5-7-14-6-3-4-11-20-14/h1-4,6,8-9,11-13H,5,7,10H2,(H,22,24)
InChIKeyWHBZOONZYJXVAK-UHFFFAOYSA-N
MW324.36 g/mol
LogP3.37
Rot. Bonds6

About N-[1-(2-fluorophenyl)pyrazol-4-yl]-4-pyridin-2-ylbutanamide

N-[1-(2-fluorophenyl)pyrazol-4-yl]-4-pyridin-2-ylbutanamide (PubChem CID 71856417) has the molecular formula C18H17FN4O and a molecular weight of 324.36 g/mol. Its IUPAC name is N-[1-(2-fluorophenyl)pyrazol-4-yl]-4-pyridin-2-ylbutanamide.

Molecular Properties

Compound NameN-[1-(2-fluorophenyl)pyrazol-4-yl]-4-pyridin-2-ylbutanamide
PubChem CID71856417
Molecular FormulaC18H17FN4O
Molecular Weight324.36 g/mol
Exact Mass324.14
IUPAC NameN-[1-(2-fluorophenyl)pyrazol-4-yl]-4-pyridin-2-ylbutanamide
SMILESO=C(CCCc1ccccn1)Nc1cnn(-c2ccccc2F)c1
InChIInChI=1S/C18H17FN4O/c19-16-8-1-2-9-17(16)23-13-15(12-21-23)22-18(24)10-5-7-14-6-3-4-11-20-14/h1-4,6,8-9,11-13H,5,7,10H2,(H,22,24)
InChIKeyWHBZOONZYJXVAK-UHFFFAOYSA-N
XLogP3.37
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.36
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[1-(2-fluorophenyl)pyrazol-4-yl]-4-pyridin-2-ylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-fluoro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-2-carboxamide
CID 99821177
N-[1-(2-fluorophenyl)pyrazol-4-yl]-2-(2-oxopiperidin-1-yl)acetamide
CID 71856412
N-(2,6-difluorophenyl)-3-pyridin-2-ylpropanamide
CID 110389270
3-pyridin-2-yl-N-pyridin-3-ylpropanamide
CID 47468155
(2S)-2-amino-N-[1-(2-fluorophenyl)pyrazol-4-yl]-3-methylbutanamide
CID 119329634
N-[1-(2-fluorophenyl)pyrazol-4-yl]cyclohexanecarboxamide
CID 141275060
1-ethyl-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyrazole-4-carboxamide
CID 71921815
4-pyridin-2-yl-N-(3-pyridin-2-ylpropyl)butanamide
CID 166230056
N-[4-chloro-3-(trifluoromethyl)phenyl]-4-pyridin-2-ylbutanamide
CID 141052646
N'-[1-(2-fluorophenyl)pyrazol-4-yl]propane-1,3-diamine
CID 117210967
N-(3-amino-4-fluorophenyl)-3-pyridin-2-ylpropanamide
CID 81466595
4-pyridin-2-yl-N-(3-pyrimidin-2-yloxyphenyl)butanamide
CID 75371190

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-fluorophenyl)pyrazol-4-yl]-4-pyridin-2-ylbutanamide?
The IUPAC name of N-[1-(2-fluorophenyl)pyrazol-4-yl]-4-pyridin-2-ylbutanamide (CID 71856417) is N-[1-(2-fluorophenyl)pyrazol-4-yl]-4-pyridin-2-ylbutanamide.
What is the SMILES notation for N-[1-(2-fluorophenyl)pyrazol-4-yl]-4-pyridin-2-ylbutanamide?
The canonical SMILES for N-[1-(2-fluorophenyl)pyrazol-4-yl]-4-pyridin-2-ylbutanamide is O=C(CCCc1ccccn1)Nc1cnn(-c2ccccc2F)c1.
What is the InChIKey of N-[1-(2-fluorophenyl)pyrazol-4-yl]-4-pyridin-2-ylbutanamide?
The InChIKey is WHBZOONZYJXVAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN4O/c19-16-8-1-2-9-17(16)23-13-15(12-21-23)22-18(24)10-5-7-14-6-3-4-11-20-14/h1-4,6,8-9,11-13H,5,7,10H2,(H,22,24).
What are the key properties of N-[1-(2-fluorophenyl)pyrazol-4-yl]-4-pyridin-2-ylbutanamide?
N-[1-(2-fluorophenyl)pyrazol-4-yl]-4-pyridin-2-ylbutanamide has a molecular weight of 324.36 g/mol, XLogP of 3.37, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-fluorophenyl)pyrazol-4-yl]-4-pyridin-2-ylbutanamide is sourced from PubChem (CID 71856417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).