4-amino-5-fluoro-3,4-dihydro-1H-pyridin-2-one

C5H7FN2O — CID 143858460

IUPAC4-amino-5-fluoro-3,4-dihydro-1H-pyridin-2-one
SMILESNC1CC(=O)NC=C1F
InChIInChI=1S/C5H7FN2O/c6-3-2-8-5(9)1-4(3)7/h2,4H,1,7H2,(H,8,9)
InChIKeyQPGXGCBRBASFSF-UHFFFAOYSA-N
MW130.12 g/mol
LogP-0.36
Rot. Bonds

About 4-amino-5-fluoro-3,4-dihydro-1H-pyridin-2-one

4-amino-5-fluoro-3,4-dihydro-1H-pyridin-2-one (PubChem CID 143858460) has the molecular formula C5H7FN2O and a molecular weight of 130.12 g/mol. Its IUPAC name is 4-amino-5-fluoro-3,4-dihydro-1H-pyridin-2-one.

Molecular Properties

Compound Name4-amino-5-fluoro-3,4-dihydro-1H-pyridin-2-one
PubChem CID143858460
Molecular FormulaC5H7FN2O
Molecular Weight130.12 g/mol
Exact Mass130.05
IUPAC Name4-amino-5-fluoro-3,4-dihydro-1H-pyridin-2-one
SMILESNC1CC(=O)NC=C1F
InChIInChI=1S/C5H7FN2O/c6-3-2-8-5(9)1-4(3)7/h2,4H,1,7H2,(H,8,9)
InChIKeyQPGXGCBRBASFSF-UHFFFAOYSA-N
XLogP-0.36
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.12
LogP ≤ 5-0.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-amino-5-fluoro-3,4-dihydro-1H-pyridin-2-one?
The IUPAC name of 4-amino-5-fluoro-3,4-dihydro-1H-pyridin-2-one (CID 143858460) is 4-amino-5-fluoro-3,4-dihydro-1H-pyridin-2-one.
What is the SMILES notation for 4-amino-5-fluoro-3,4-dihydro-1H-pyridin-2-one?
The canonical SMILES for 4-amino-5-fluoro-3,4-dihydro-1H-pyridin-2-one is NC1CC(=O)NC=C1F.
What is the InChIKey of 4-amino-5-fluoro-3,4-dihydro-1H-pyridin-2-one?
The InChIKey is QPGXGCBRBASFSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7FN2O/c6-3-2-8-5(9)1-4(3)7/h2,4H,1,7H2,(H,8,9).
What are the key properties of 4-amino-5-fluoro-3,4-dihydro-1H-pyridin-2-one?
4-amino-5-fluoro-3,4-dihydro-1H-pyridin-2-one has a molecular weight of 130.12 g/mol, XLogP of -0.36, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-fluoro-3,4-dihydro-1H-pyridin-2-one is sourced from PubChem (CID 143858460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).