7-(dimethylamino)-2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)pyrido[1,2-a]pyrimidin-4-one

C23H24FN5O4 — CID 147940651

IUPAC7-(dimethylamino)-2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)pyrido[1,2-a]pyrimidin-4-one
SMILESCN1CCN(c2cc(N(C)C)cn3c(=O)c(O)c(C(=O)CCc4ccc(F)cc4)nc23)C1=O
InChIInChI=1S/C23H24FN5O4/c1-26(2)16-12-17(28-11-10-27(3)23(28)33)21-25-19(20(31)22(32)29(21)13-16)18(30)9-6-14-4-7-15(24)8-5-14/h4-5,7-8,12-13,31H,6,9-11H2,1-3H3
InChIKeyILRGUBPTTHHQNL-UHFFFAOYSA-N
MW453.47 g/mol
LogP2.29
Rot. Bonds6

About 7-(dimethylamino)-2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)pyrido[1,2-a]pyrimidin-4-one

7-(dimethylamino)-2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)pyrido[1,2-a]pyrimidin-4-one (PubChem CID 147940651) has the molecular formula C23H24FN5O4 and a molecular weight of 453.47 g/mol. Its IUPAC name is 7-(dimethylamino)-2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)pyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name7-(dimethylamino)-2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)pyrido[1,2-a]pyrimidin-4-one
PubChem CID147940651
Molecular FormulaC23H24FN5O4
Molecular Weight453.47 g/mol
Exact Mass453.18
IUPAC Name7-(dimethylamino)-2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)pyrido[1,2-a]pyrimidin-4-one
SMILESCN1CCN(c2cc(N(C)C)cn3c(=O)c(O)c(C(=O)CCc4ccc(F)cc4)nc23)C1=O
InChIInChI=1S/C23H24FN5O4/c1-26(2)16-12-17(28-11-10-27(3)23(28)33)21-25-19(20(31)22(32)29(21)13-16)18(30)9-6-14-4-7-15(24)8-5-14/h4-5,7-8,12-13,31H,6,9-11H2,1-3H3
InChIKeyILRGUBPTTHHQNL-UHFFFAOYSA-N
XLogP2.29
TPSA98.46 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500453.47
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 7-(dimethylamino)-2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)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

7-(dimethylamino)-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)-4-oxopyrido[1,2-a]pyrimidine-2-carboxylic acid
CID 66667901
2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-7-(4-methylpiperazin-1-yl)-9-(2-oxopyrrolidin-1-yl)pyrido[1,2-a]pyrimidin-4-one
CID 158459916
2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-9-(2-oxopiperazin-1-yl)-7-piperidin-1-ylpyrido[1,2-a]pyrimidin-4-one
CID 158964968
ethyl N-[2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-7-iodo-4-oxopyrido[1,2-a]pyrimidin-9-yl]carbamate
CID 58101034
chloromethane;2-[5-[(4-fluorophenyl)methyl]-1H-imidazol-2-yl]-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)-7-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 143919832
2-[5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl]-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)-7-(4-propan-2-ylpiperazin-1-yl)pyrido[1,2-a]pyrimidin-4-one
CID 135908116
2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-8,9-dimethyl-7,9-dihydro-6H-pyrazino[1,2-a]pyrimidin-4-one
CID 58476882
2-[2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-4-oxo-7,9-dihydro-6H-pyrazino[1,2-a]pyrimidin-8-yl]-N,N-dimethyl-2-oxoacetamide
CID 58476832
9-[3-(dimethylamino)-2-oxopyrrolidin-1-yl]-N-[(4-fluorophenyl)methyl]-3-hydroxy-7-(4-methylpiperazin-1-yl)-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide
CID 71595461
N-[(4-fluorophenyl)methyl]-3-hydroxy-7-(4-methylpiperazin-1-yl)-4-oxo-9-(2-oxopyrrolidin-1-yl)pyrido[1,2-a]pyrimidine-2-carboxamide
CID 66669233
9-(4-tert-butyl-2-oxopiperazin-1-yl)-7-(dimethylamino)-N-[(4-fluorophenyl)methyl]-4-oxo-3-phenylmethoxypyrido[1,2-a]pyrimidine-2-carboxamide
CID 123833250
8-benzyl-2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-9,9-dimethyl-6,7-dihydropyrazino[1,2-a]pyrimidin-4-one
CID 58476803

Frequently Asked Questions

What is the IUPAC name of 7-(dimethylamino)-2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)pyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 7-(dimethylamino)-2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)pyrido[1,2-a]pyrimidin-4-one (CID 147940651) is 7-(dimethylamino)-2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)pyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 7-(dimethylamino)-2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)pyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 7-(dimethylamino)-2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)pyrido[1,2-a]pyrimidin-4-one is CN1CCN(c2cc(N(C)C)cn3c(=O)c(O)c(C(=O)CCc4ccc(F)cc4)nc23)C1=O.
What is the InChIKey of 7-(dimethylamino)-2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)pyrido[1,2-a]pyrimidin-4-one?
The InChIKey is ILRGUBPTTHHQNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24FN5O4/c1-26(2)16-12-17(28-11-10-27(3)23(28)33)21-25-19(20(31)22(32)29(21)13-16)18(30)9-6-14-4-7-15(24)8-5-14/h4-5,7-8,12-13,31H,6,9-11H2,1-3H3.
What are the key properties of 7-(dimethylamino)-2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)pyrido[1,2-a]pyrimidin-4-one?
7-(dimethylamino)-2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)pyrido[1,2-a]pyrimidin-4-one has a molecular weight of 453.47 g/mol, XLogP of 2.29, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(dimethylamino)-2-[3-(4-fluorophenyl)propanoyl]-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)pyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 147940651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).