2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-1,3-dihydroimidazo[1,2-c]quinazolin-5-one

C22H24FN5O — CID 172826126

IUPAC2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-1,3-dihydroimidazo[1,2-c]quinazolin-5-one
SMILESCC1(N2CCN(Cc3ccc(F)cc3)CC2)Cn2c(c3ccccc3nc2=O)N1
InChIInChI=1S/C22H24FN5O/c1-22(15-28-20(25-22)18-4-2-3-5-19(18)24-21(28)29)27-12-10-26(11-13-27)14-16-6-8-17(23)9-7-16/h2-9,25H,10-15H2,1H3
InChIKeyYEEASLZMNVPSES-UHFFFAOYSA-N
MW393.47 g/mol
LogP2.50
Rot. Bonds3

About 2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-1,3-dihydroimidazo[1,2-c]quinazolin-5-one

2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-1,3-dihydroimidazo[1,2-c]quinazolin-5-one (PubChem CID 172826126) has the molecular formula C22H24FN5O and a molecular weight of 393.47 g/mol. Its IUPAC name is 2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-1,3-dihydroimidazo[1,2-c]quinazolin-5-one.

Molecular Properties

Compound Name2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-1,3-dihydroimidazo[1,2-c]quinazolin-5-one
PubChem CID172826126
Molecular FormulaC22H24FN5O
Molecular Weight393.47 g/mol
Exact Mass393.20
IUPAC Name2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-1,3-dihydroimidazo[1,2-c]quinazolin-5-one
SMILESCC1(N2CCN(Cc3ccc(F)cc3)CC2)Cn2c(c3ccccc3nc2=O)N1
InChIInChI=1S/C22H24FN5O/c1-22(15-28-20(25-22)18-4-2-3-5-19(18)24-21(28)29)27-12-10-26(11-13-27)14-16-6-8-17(23)9-7-16/h2-9,25H,10-15H2,1H3
InChIKeyYEEASLZMNVPSES-UHFFFAOYSA-N
XLogP2.50
TPSA53.40 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.47
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-1,3-dihydroimidazo[1,2-c]quinazolin-5-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-1,3-dihydroimidazo[1,2-c]quinazolin-5-one?
The IUPAC name of 2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-1,3-dihydroimidazo[1,2-c]quinazolin-5-one (CID 172826126) is 2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-1,3-dihydroimidazo[1,2-c]quinazolin-5-one.
What is the SMILES notation for 2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-1,3-dihydroimidazo[1,2-c]quinazolin-5-one?
The canonical SMILES for 2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-1,3-dihydroimidazo[1,2-c]quinazolin-5-one is CC1(N2CCN(Cc3ccc(F)cc3)CC2)Cn2c(c3ccccc3nc2=O)N1.
What is the InChIKey of 2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-1,3-dihydroimidazo[1,2-c]quinazolin-5-one?
The InChIKey is YEEASLZMNVPSES-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24FN5O/c1-22(15-28-20(25-22)18-4-2-3-5-19(18)24-21(28)29)27-12-10-26(11-13-27)14-16-6-8-17(23)9-7-16/h2-9,25H,10-15H2,1H3.
What are the key properties of 2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-1,3-dihydroimidazo[1,2-c]quinazolin-5-one?
2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-1,3-dihydroimidazo[1,2-c]quinazolin-5-one has a molecular weight of 393.47 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-1,3-dihydroimidazo[1,2-c]quinazolin-5-one is sourced from PubChem (CID 172826126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).