(4-amino-3-pyridinyl)-(4-fluorophenyl)methanone

C12H9FN2O — CID 11074797

IUPAC(4-amino-3-pyridinyl)-(4-fluorophenyl)methanone
SMILESNc1ccncc1C(=O)c1ccc(F)cc1
InChIInChI=1S/C12H9FN2O/c13-9-3-1-8(2-4-9)12(16)10-7-15-6-5-11(10)14/h1-7H,(H2,14,15)
InChIKeyLONPXALBMZWWPJ-UHFFFAOYSA-N
MW216.22 g/mol
LogP2.03
Rot. Bonds2

About (4-amino-3-pyridinyl)-(4-fluorophenyl)methanone

(4-amino-3-pyridinyl)-(4-fluorophenyl)methanone (PubChem CID 11074797) has the molecular formula C12H9FN2O and a molecular weight of 216.22 g/mol. Its IUPAC name is (4-amino-3-pyridinyl)-(4-fluorophenyl)methanone.

Molecular Properties

Compound Name(4-amino-3-pyridinyl)-(4-fluorophenyl)methanone
PubChem CID11074797
Molecular FormulaC12H9FN2O
Molecular Weight216.22 g/mol
Exact Mass216.07
IUPAC Name(4-amino-3-pyridinyl)-(4-fluorophenyl)methanone
SMILESNc1ccncc1C(=O)c1ccc(F)cc1
InChIInChI=1S/C12H9FN2O/c13-9-3-1-8(2-4-9)12(16)10-7-15-6-5-11(10)14/h1-7H,(H2,14,15)
InChIKeyLONPXALBMZWWPJ-UHFFFAOYSA-N
XLogP2.03
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.22
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-aminophenyl)-(4-amino-3-pyridinyl)methanone
CID 116548721
[4-(aminomethyl)phenyl]-(4-amino-3-pyridinyl)methanone
CID 116548154
(4-amino-3-pyridinyl)-(3-bromo-4-fluorophenyl)methanone
CID 82809025
4-(4-fluorobenzoyl)pyridine-3-carboxylic acid
CID 10752867
(4-amino-3-pyridinyl)-(4-bromo-3,5-dimethylphenyl)methanone
CID 114329651
4-aminopyridine-3-carbonitrile;(4-amino-3-pyridinyl)-phenylmethanone
CID 159414201
(2-amino-5-hydroxyphenyl)-(4-fluorophenyl)methanone
CID 105489008
(4-fluorophenyl)-pyridin-3-ylmethanone
CID 762660
(4-amino-3-fluorophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanone
CID 102709294
(2-amino-5-fluorophenyl)-(4-bromophenyl)methanone
CID 13408104
2-amino-1-(4-amino-3-pyridinyl)-3,3,3-trifluoro-2-methylpropan-1-one
CID 116592894
(3-amino-4-pyridinyl)-[4-(trifluoromethoxy)phenyl]methanone
CID 53414396

Frequently Asked Questions

What is the IUPAC name of (4-amino-3-pyridinyl)-(4-fluorophenyl)methanone?
The IUPAC name of (4-amino-3-pyridinyl)-(4-fluorophenyl)methanone (CID 11074797) is (4-amino-3-pyridinyl)-(4-fluorophenyl)methanone.
What is the SMILES notation for (4-amino-3-pyridinyl)-(4-fluorophenyl)methanone?
The canonical SMILES for (4-amino-3-pyridinyl)-(4-fluorophenyl)methanone is Nc1ccncc1C(=O)c1ccc(F)cc1.
What is the InChIKey of (4-amino-3-pyridinyl)-(4-fluorophenyl)methanone?
The InChIKey is LONPXALBMZWWPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9FN2O/c13-9-3-1-8(2-4-9)12(16)10-7-15-6-5-11(10)14/h1-7H,(H2,14,15).
What are the key properties of (4-amino-3-pyridinyl)-(4-fluorophenyl)methanone?
(4-amino-3-pyridinyl)-(4-fluorophenyl)methanone has a molecular weight of 216.22 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-3-pyridinyl)-(4-fluorophenyl)methanone is sourced from PubChem (CID 11074797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).