3-amino-1-[(3-fluorophenyl)methyl]pyridin-2-one

C12H11FN2O — CID 62101796

IUPAC3-amino-1-[(3-fluorophenyl)methyl]pyridin-2-one
SMILESNc1cccn(Cc2cccc(F)c2)c1=O
InChIInChI=1S/C12H11FN2O/c13-10-4-1-3-9(7-10)8-15-6-2-5-11(14)12(15)16/h1-7H,8,14H2
InChIKeyLJROGHMSMRNXOU-UHFFFAOYSA-N
MW218.23 g/mol
LogP1.62
Rot. Bonds2

About 3-amino-1-[(3-fluorophenyl)methyl]pyridin-2-one

3-amino-1-[(3-fluorophenyl)methyl]pyridin-2-one (PubChem CID 62101796) has the molecular formula C12H11FN2O and a molecular weight of 218.23 g/mol. Its IUPAC name is 3-amino-1-[(3-fluorophenyl)methyl]pyridin-2-one.

Molecular Properties

Compound Name3-amino-1-[(3-fluorophenyl)methyl]pyridin-2-one
PubChem CID62101796
Molecular FormulaC12H11FN2O
Molecular Weight218.23 g/mol
Exact Mass218.09
IUPAC Name3-amino-1-[(3-fluorophenyl)methyl]pyridin-2-one
SMILESNc1cccn(Cc2cccc(F)c2)c1=O
InChIInChI=1S/C12H11FN2O/c13-10-4-1-3-9(7-10)8-15-6-2-5-11(14)12(15)16/h1-7H,8,14H2
InChIKeyLJROGHMSMRNXOU-UHFFFAOYSA-N
XLogP1.62
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.23
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-1-[(3,5-difluorophenyl)methyl]pyridin-2-one
CID 105403383
4-amino-3-bromo-1-[(3-fluorophenyl)methyl]pyridin-2-one;hydrochloride
CID 22050881
3-amino-1-[(3-bromo-5-fluorophenyl)methyl]pyridin-2-one
CID 79710063
1-[(3-fluorophenyl)methyl]-2-oxopyridine-3-carbaldehyde
CID 96600000
3-amino-1-[(2,6-difluorophenyl)methyl]pyridin-2-one
CID 114930175
3-chloro-1-[(3-fluorophenyl)methyl]pyrazin-2-one
CID 114561720
1-[(3-fluorophenyl)methyl]pyrrole-2-carbothioamide
CID 114654140
3-amino-1-[(4-iodophenyl)methyl]pyridin-2-one
CID 65478210
3-[(3-fluorophenyl)methyl]-1,3-thiazol-2-one
CID 115646822
N-(1-benzyl-2-oxo-3-pyridinyl)-2-(3-fluorophenyl)acetamide
CID 71921768
3-fluoro-1-[(3-methylphenyl)methyl]pyridin-2-one
CID 174323463
3-bromo-1-[(3-fluorophenyl)methyl]-4-phenylpyridin-2-one
CID 71201156

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-[(3-fluorophenyl)methyl]pyridin-2-one?
The IUPAC name of 3-amino-1-[(3-fluorophenyl)methyl]pyridin-2-one (CID 62101796) is 3-amino-1-[(3-fluorophenyl)methyl]pyridin-2-one.
What is the SMILES notation for 3-amino-1-[(3-fluorophenyl)methyl]pyridin-2-one?
The canonical SMILES for 3-amino-1-[(3-fluorophenyl)methyl]pyridin-2-one is Nc1cccn(Cc2cccc(F)c2)c1=O.
What is the InChIKey of 3-amino-1-[(3-fluorophenyl)methyl]pyridin-2-one?
The InChIKey is LJROGHMSMRNXOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FN2O/c13-10-4-1-3-9(7-10)8-15-6-2-5-11(14)12(15)16/h1-7H,8,14H2.
What are the key properties of 3-amino-1-[(3-fluorophenyl)methyl]pyridin-2-one?
3-amino-1-[(3-fluorophenyl)methyl]pyridin-2-one has a molecular weight of 218.23 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-[(3-fluorophenyl)methyl]pyridin-2-one is sourced from PubChem (CID 62101796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).