7-fluoro-3-(3-fluorophenyl)-2-[1-(2-methylhydrazinyl)ethyl]pyrido[1,2-a]pyrimidin-4-one

C17H16F2N4O — CID 146421483

IUPAC7-fluoro-3-(3-fluorophenyl)-2-[1-(2-methylhydrazinyl)ethyl]pyrido[1,2-a]pyrimidin-4-one
SMILESCNNC(C)c1nc2ccc(F)cn2c(=O)c1-c1cccc(F)c1
InChIInChI=1S/C17H16F2N4O/c1-10(22-20-2)16-15(11-4-3-5-12(18)8-11)17(24)23-9-13(19)6-7-14(23)21-16/h3-10,20,22H,1-2H3
InChIKeyRIZIXLPOKDBKQN-UHFFFAOYSA-N
MW330.34 g/mol
LogP2.42
Rot. Bonds4

About 7-fluoro-3-(3-fluorophenyl)-2-[1-(2-methylhydrazinyl)ethyl]pyrido[1,2-a]pyrimidin-4-one

7-fluoro-3-(3-fluorophenyl)-2-[1-(2-methylhydrazinyl)ethyl]pyrido[1,2-a]pyrimidin-4-one (PubChem CID 146421483) has the molecular formula C17H16F2N4O and a molecular weight of 330.34 g/mol. Its IUPAC name is 7-fluoro-3-(3-fluorophenyl)-2-[1-(2-methylhydrazinyl)ethyl]pyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name7-fluoro-3-(3-fluorophenyl)-2-[1-(2-methylhydrazinyl)ethyl]pyrido[1,2-a]pyrimidin-4-one
PubChem CID146421483
Molecular FormulaC17H16F2N4O
Molecular Weight330.34 g/mol
Exact Mass330.13
IUPAC Name7-fluoro-3-(3-fluorophenyl)-2-[1-(2-methylhydrazinyl)ethyl]pyrido[1,2-a]pyrimidin-4-one
SMILESCNNC(C)c1nc2ccc(F)cn2c(=O)c1-c1cccc(F)c1
InChIInChI=1S/C17H16F2N4O/c1-10(22-20-2)16-15(11-4-3-5-12(18)8-11)17(24)23-9-13(19)6-7-14(23)21-16/h3-10,20,22H,1-2H3
InChIKeyRIZIXLPOKDBKQN-UHFFFAOYSA-N
XLogP2.42
TPSA58.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.34
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 7-fluoro-3-(3-fluorophenyl)-2-[1-(2-methylhydrazinyl)ethyl]pyrido[1,2-a]pyrimidin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(1R)-1-[[6-amino-5-(1-propan-2-ylpyrazole-4-carboximidoyl)pyrimidin-4-yl]amino]ethyl]-7-fluoro-3-(3-fluorophenyl)pyrido[1,2-a]pyrimidin-4-one
CID 164731132
2-[1-[4-amino-3-(2-methyl-1,3-thiazol-5-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-7-fluoro-3-(3-fluorophenyl)pyrido[1,2-a]pyrimidin-4-one
CID 164731134
2-[(1S)-1-[4-amino-3-(2-methoxy-1,3-thiazol-5-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-7-fluoro-3-(3-fluorophenyl)pyrido[1,2-a]pyrimidin-4-one;2-[(1R)-1-[4-amino-3-(2-methoxy-1,3-thiazol-5-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-7-fluoro-3-(3-fluorophenyl)pyrido[1,2-a]pyrimidin-4-one;methane
CID 164962281
5-[4-amino-1-[(1R)-1-[7-fluoro-3-(3-fluorophenyl)-4-oxopyrido[1,2-a]pyrimidin-2-yl]ethyl]pyrazolo[3,4-d]pyrimidin-3-yl]-3-fluoro-2-methoxybenzonitrile
CID 146421346
6-fluoro-3-(3-fluorophenyl)-2-methylimidazo[1,2-a]pyridine
CID 114835263
6-(3-fluorophenyl)-7-[(1S)-1-hydrazinylethyl]-3-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 167431851
2-[(1S)-1-[4-amino-3-[2-(2,2,2-trifluoroethoxy)-1,3-thiazol-5-yl]pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-7-fluoro-3-(3-fluorophenyl)pyrido[1,2-a]pyrimidin-4-one;2-[(1R)-1-[4-amino-3-[2-(2,2,2-trifluoroethoxy)-1,3-thiazol-5-yl]pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-7-fluoro-3-(3-fluorophenyl)pyrido[1,2-a]pyrimidin-4-one;2-[1-[4-amino-3-[2-(2,2,2-trifluoroethoxy)-1,3-thiazol-5-yl]pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-7-fluoro-3-(3-fluorophenyl)pyrido[1,2-a]pyrimidin-4-one;carbanide;methane;methyl thiohypofluorite;tungsten
CID 165053426
1-[6-chloro-3-(3-fluorophenyl)imidazo[1,2-a]pyridin-2-yl]ethanamine
CID 67258517
4-amino-6-[1-[7-fluoro-3-(3-fluorophenyl)-4-oxoquinolizin-2-yl]ethylamino]pyrimidine-5-carbonitrile
CID 118627726
2-[(1S)-1-[4-amino-5-(3-fluoro-4-propan-2-yloxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]ethyl]-7-chloro-3-(3-fluorophenyl)pyrido[1,2-a]pyrimidin-4-one
CID 164731141
2-[1-[4-amino-3-(2-propan-2-yloxy-1,3-thiazol-5-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-3-(3-fluorophenyl)-7-methylpyrido[1,2-a]pyrimidin-4-one
CID 146421378
2-[(1S)-1-[4-amino-3-(2-tert-butyl-1,3-thiazol-5-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-3-(3-fluorophenyl)-7-methylpyrido[1,2-a]pyrimidin-4-one
CID 146420791

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-3-(3-fluorophenyl)-2-[1-(2-methylhydrazinyl)ethyl]pyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 7-fluoro-3-(3-fluorophenyl)-2-[1-(2-methylhydrazinyl)ethyl]pyrido[1,2-a]pyrimidin-4-one (CID 146421483) is 7-fluoro-3-(3-fluorophenyl)-2-[1-(2-methylhydrazinyl)ethyl]pyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 7-fluoro-3-(3-fluorophenyl)-2-[1-(2-methylhydrazinyl)ethyl]pyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 7-fluoro-3-(3-fluorophenyl)-2-[1-(2-methylhydrazinyl)ethyl]pyrido[1,2-a]pyrimidin-4-one is CNNC(C)c1nc2ccc(F)cn2c(=O)c1-c1cccc(F)c1.
What is the InChIKey of 7-fluoro-3-(3-fluorophenyl)-2-[1-(2-methylhydrazinyl)ethyl]pyrido[1,2-a]pyrimidin-4-one?
The InChIKey is RIZIXLPOKDBKQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F2N4O/c1-10(22-20-2)16-15(11-4-3-5-12(18)8-11)17(24)23-9-13(19)6-7-14(23)21-16/h3-10,20,22H,1-2H3.
What are the key properties of 7-fluoro-3-(3-fluorophenyl)-2-[1-(2-methylhydrazinyl)ethyl]pyrido[1,2-a]pyrimidin-4-one?
7-fluoro-3-(3-fluorophenyl)-2-[1-(2-methylhydrazinyl)ethyl]pyrido[1,2-a]pyrimidin-4-one has a molecular weight of 330.34 g/mol, XLogP of 2.42, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-3-(3-fluorophenyl)-2-[1-(2-methylhydrazinyl)ethyl]pyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 146421483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).