N-[4-fluoro-2-(pyridin-2-ylamino)phenyl]propanamide

C14H14FN3O — CID 123802200

IUPACN-[4-fluoro-2-(pyridin-2-ylamino)phenyl]propanamide
SMILESCCC(=O)Nc1ccc(F)cc1Nc1ccccn1
InChIInChI=1S/C14H14FN3O/c1-2-14(19)18-11-7-6-10(15)9-12(11)17-13-5-3-4-8-16-13/h3-9H,2H2,1H3,(H,16,17)(H,18,19)
InChIKeyFZODMIDXGYQWHP-UHFFFAOYSA-N
MW259.28 g/mol
LogP3.31
Rot. Bonds4

About N-[4-fluoro-2-(pyridin-2-ylamino)phenyl]propanamide

N-[4-fluoro-2-(pyridin-2-ylamino)phenyl]propanamide (PubChem CID 123802200) has the molecular formula C14H14FN3O and a molecular weight of 259.28 g/mol. Its IUPAC name is N-[4-fluoro-2-(pyridin-2-ylamino)phenyl]propanamide.

Molecular Properties

Compound NameN-[4-fluoro-2-(pyridin-2-ylamino)phenyl]propanamide
PubChem CID123802200
Molecular FormulaC14H14FN3O
Molecular Weight259.28 g/mol
Exact Mass259.11
IUPAC NameN-[4-fluoro-2-(pyridin-2-ylamino)phenyl]propanamide
SMILESCCC(=O)Nc1ccc(F)cc1Nc1ccccn1
InChIInChI=1S/C14H14FN3O/c1-2-14(19)18-11-7-6-10(15)9-12(11)17-13-5-3-4-8-16-13/h3-9H,2H2,1H3,(H,16,17)(H,18,19)
InChIKeyFZODMIDXGYQWHP-UHFFFAOYSA-N
XLogP3.31
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.28
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,4-difluorophenyl)pyridin-2-amine
CID 14914349
N-(2-bromo-4-fluorophenyl)propanamide
CID 28938564
N-(5-fluoro-2-pyridin-2-ylphenyl)pyridin-2-amine
CID 177414245
N-[4-[[2-methyl-6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]phenyl]propanamide
CID 122316969
N-[5-fluoro-2-(methanesulfonamido)phenyl]propanamide
CID 113093309
tert-butyl N-[4-fluoro-2-(propanoylamino)phenyl]carbamate
CID 56783735
ethane;(E)-3-(4-fluorophenyl)-2-methoxy-N-[4-methyl-3-(pyridin-2-ylamino)phenyl]pent-2-enamide
CID 169200051
methyl 5-fluoro-2-(propanoylamino)benzoate
CID 60787953
N-(2-cyano-4-fluorophenyl)propanamide
CID 79952819
N-[4-fluoro-2-[[2-(4-fluorophenyl)sulfanylacetyl]amino]phenyl]pyridine-2-carboxamide
CID 55834013
N-[4-(pyridin-2-ylsulfamoyl)phenyl]propanamide
CID 725106
N-(2,5-difluorophenyl)-2-[4-[2-(pyridin-2-ylamino)-4-pyridinyl]piperidin-1-yl]acetamide
CID 110109854

Frequently Asked Questions

What is the IUPAC name of N-[4-fluoro-2-(pyridin-2-ylamino)phenyl]propanamide?
The IUPAC name of N-[4-fluoro-2-(pyridin-2-ylamino)phenyl]propanamide (CID 123802200) is N-[4-fluoro-2-(pyridin-2-ylamino)phenyl]propanamide.
What is the SMILES notation for N-[4-fluoro-2-(pyridin-2-ylamino)phenyl]propanamide?
The canonical SMILES for N-[4-fluoro-2-(pyridin-2-ylamino)phenyl]propanamide is CCC(=O)Nc1ccc(F)cc1Nc1ccccn1.
What is the InChIKey of N-[4-fluoro-2-(pyridin-2-ylamino)phenyl]propanamide?
The InChIKey is FZODMIDXGYQWHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN3O/c1-2-14(19)18-11-7-6-10(15)9-12(11)17-13-5-3-4-8-16-13/h3-9H,2H2,1H3,(H,16,17)(H,18,19).
What are the key properties of N-[4-fluoro-2-(pyridin-2-ylamino)phenyl]propanamide?
N-[4-fluoro-2-(pyridin-2-ylamino)phenyl]propanamide has a molecular weight of 259.28 g/mol, XLogP of 3.31, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-fluoro-2-(pyridin-2-ylamino)phenyl]propanamide is sourced from PubChem (CID 123802200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).