3-(4-fluorophenyl)-N-pyridin-4-ylpropanamide

C14H13FN2O — CID 30157880

IUPAC3-(4-fluorophenyl)-N-pyridin-4-ylpropanamide
SMILESO=C(CCc1ccc(F)cc1)Nc1ccncc1
InChIInChI=1S/C14H13FN2O/c15-12-4-1-11(2-5-12)3-6-14(18)17-13-7-9-16-10-8-13/h1-2,4-5,7-10H,3,6H2,(H,16,17,18)
InChIKeyQSAPIDLNWSENMI-UHFFFAOYSA-N
MW244.27 g/mol
LogP2.79
Rot. Bonds4

About 3-(4-fluorophenyl)-N-pyridin-4-ylpropanamide

3-(4-fluorophenyl)-N-pyridin-4-ylpropanamide (PubChem CID 30157880) has the molecular formula C14H13FN2O and a molecular weight of 244.27 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-N-pyridin-4-ylpropanamide.

Molecular Properties

Compound Name3-(4-fluorophenyl)-N-pyridin-4-ylpropanamide
PubChem CID30157880
Molecular FormulaC14H13FN2O
Molecular Weight244.27 g/mol
Exact Mass244.10
IUPAC Name3-(4-fluorophenyl)-N-pyridin-4-ylpropanamide
SMILESO=C(CCc1ccc(F)cc1)Nc1ccncc1
InChIInChI=1S/C14H13FN2O/c15-12-4-1-11(2-5-12)3-6-14(18)17-13-7-9-16-10-8-13/h1-2,4-5,7-10H,3,6H2,(H,16,17,18)
InChIKeyQSAPIDLNWSENMI-UHFFFAOYSA-N
XLogP2.79
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.27
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-N-pyridin-4-ylpropanamide?
The IUPAC name of 3-(4-fluorophenyl)-N-pyridin-4-ylpropanamide (CID 30157880) is 3-(4-fluorophenyl)-N-pyridin-4-ylpropanamide.
What is the SMILES notation for 3-(4-fluorophenyl)-N-pyridin-4-ylpropanamide?
The canonical SMILES for 3-(4-fluorophenyl)-N-pyridin-4-ylpropanamide is O=C(CCc1ccc(F)cc1)Nc1ccncc1.
What is the InChIKey of 3-(4-fluorophenyl)-N-pyridin-4-ylpropanamide?
The InChIKey is QSAPIDLNWSENMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O/c15-12-4-1-11(2-5-12)3-6-14(18)17-13-7-9-16-10-8-13/h1-2,4-5,7-10H,3,6H2,(H,16,17,18).
What are the key properties of 3-(4-fluorophenyl)-N-pyridin-4-ylpropanamide?
3-(4-fluorophenyl)-N-pyridin-4-ylpropanamide has a molecular weight of 244.27 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-N-pyridin-4-ylpropanamide is sourced from PubChem (CID 30157880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).