4-[4-(2-fluorophenyl)phenyl]-N-pyridin-3-ylbutanamide

C21H19FN2O — CID 138674351

IUPAC4-[4-(2-fluorophenyl)phenyl]-N-pyridin-3-ylbutanamide
SMILESO=C(CCCc1ccc(-c2ccccc2F)cc1)Nc1cccnc1
InChIInChI=1S/C21H19FN2O/c22-20-8-2-1-7-19(20)17-12-10-16(11-13-17)5-3-9-21(25)24-18-6-4-14-23-15-18/h1-2,4,6-8,10-15H,3,5,9H2,(H,24,25)
InChIKeyWDQVNWJIRDUWDY-UHFFFAOYSA-N
MW334.39 g/mol
LogP4.85
Rot. Bonds6

About 4-[4-(2-fluorophenyl)phenyl]-N-pyridin-3-ylbutanamide

4-[4-(2-fluorophenyl)phenyl]-N-pyridin-3-ylbutanamide (PubChem CID 138674351) has the molecular formula C21H19FN2O and a molecular weight of 334.39 g/mol. Its IUPAC name is 4-[4-(2-fluorophenyl)phenyl]-N-pyridin-3-ylbutanamide.

Molecular Properties

Compound Name4-[4-(2-fluorophenyl)phenyl]-N-pyridin-3-ylbutanamide
PubChem CID138674351
Molecular FormulaC21H19FN2O
Molecular Weight334.39 g/mol
Exact Mass334.15
IUPAC Name4-[4-(2-fluorophenyl)phenyl]-N-pyridin-3-ylbutanamide
SMILESO=C(CCCc1ccc(-c2ccccc2F)cc1)Nc1cccnc1
InChIInChI=1S/C21H19FN2O/c22-20-8-2-1-7-19(20)17-12-10-16(11-13-17)5-3-9-21(25)24-18-6-4-14-23-15-18/h1-2,4,6-8,10-15H,3,5,9H2,(H,24,25)
InChIKeyWDQVNWJIRDUWDY-UHFFFAOYSA-N
XLogP4.85
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.39
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[4-(2-fluorophenyl)phenyl]-N-(4-methylphenyl)butanamide
CID 162181441
2-[4-(2-fluorophenyl)phenyl]ethyl N-pyridin-3-ylcarbamate
CID 138674272
N-pyridin-3-yl-4-[4-[6-(trifluoromethyl)-3-pyridinyl]phenyl]butanamide
CID 138674390
5-(4-bromophenyl)-N-pyridin-3-ylpentanamide
CID 166191110
4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide
CID 138674503
4-[4-(2-fluorophenyl)phenyl]-N-(furan-2-yl)butanamide
CID 139380465
4-[4-(2-methylquinolin-6-yl)phenyl]-N-pyridin-3-ylbutanamide
CID 138674422
4-[4-(1,3-benzoxazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide
CID 138674485
4-[4-(4-amino-3-methanimidoyl-2-methylphenyl)phenyl]-N-pyridin-3-ylbutanamide
CID 164706505
4-[4-(1-methylindazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide
CID 138674494
2-(2-fluorophenyl)-N-pyridin-3-ylacetamide
CID 4195275
4-[4-(2-fluorophenyl)phenyl]-N-(3-hydroxy-1-bicyclo[1.1.1]pentanyl)butanamide
CID 138674464

Frequently Asked Questions

What is the IUPAC name of 4-[4-(2-fluorophenyl)phenyl]-N-pyridin-3-ylbutanamide?
The IUPAC name of 4-[4-(2-fluorophenyl)phenyl]-N-pyridin-3-ylbutanamide (CID 138674351) is 4-[4-(2-fluorophenyl)phenyl]-N-pyridin-3-ylbutanamide.
What is the SMILES notation for 4-[4-(2-fluorophenyl)phenyl]-N-pyridin-3-ylbutanamide?
The canonical SMILES for 4-[4-(2-fluorophenyl)phenyl]-N-pyridin-3-ylbutanamide is O=C(CCCc1ccc(-c2ccccc2F)cc1)Nc1cccnc1.
What is the InChIKey of 4-[4-(2-fluorophenyl)phenyl]-N-pyridin-3-ylbutanamide?
The InChIKey is WDQVNWJIRDUWDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19FN2O/c22-20-8-2-1-7-19(20)17-12-10-16(11-13-17)5-3-9-21(25)24-18-6-4-14-23-15-18/h1-2,4,6-8,10-15H,3,5,9H2,(H,24,25).
What are the key properties of 4-[4-(2-fluorophenyl)phenyl]-N-pyridin-3-ylbutanamide?
4-[4-(2-fluorophenyl)phenyl]-N-pyridin-3-ylbutanamide has a molecular weight of 334.39 g/mol, XLogP of 4.85, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(2-fluorophenyl)phenyl]-N-pyridin-3-ylbutanamide is sourced from PubChem (CID 138674351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).