(3-fluoro-4-methylphenyl)-[4-(3-methyl-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]methanone

C19H22FN5O — CID 53184162

IUPAC(3-fluoro-4-methylphenyl)-[4-(3-methyl-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]methanone
SMILESCc1ccc(C(=O)N2CCN(C3=NC=CN4C3=NCC4C)CC2)cc1F
InChIInChI=1S/C19H22FN5O/c1-13-3-4-15(11-16(13)20)19(26)24-9-7-23(8-10-24)17-18-22-12-14(2)25(18)6-5-21-17/h3-6,11,14H,7-10,12H2,1-2H3
InChIKeyISYWZQHUEPGTFI-UHFFFAOYSA-N
MW355.42 g/mol
LogP1.88
Rot. Bonds1

About (3-fluoro-4-methylphenyl)-[4-(3-methyl-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]methanone

(3-fluoro-4-methylphenyl)-[4-(3-methyl-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]methanone (PubChem CID 53184162) has the molecular formula C19H22FN5O and a molecular weight of 355.42 g/mol. Its IUPAC name is (3-fluoro-4-methylphenyl)-[4-(3-methyl-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]methanone.

Molecular Properties

Compound Name(3-fluoro-4-methylphenyl)-[4-(3-methyl-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]methanone
PubChem CID53184162
Molecular FormulaC19H22FN5O
Molecular Weight355.42 g/mol
Exact Mass355.18
IUPAC Name(3-fluoro-4-methylphenyl)-[4-(3-methyl-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]methanone
SMILESCc1ccc(C(=O)N2CCN(C3=NC=CN4C3=NCC4C)CC2)cc1F
InChIInChI=1S/C19H22FN5O/c1-13-3-4-15(11-16(13)20)19(26)24-9-7-23(8-10-24)17-18-22-12-14(2)25(18)6-5-21-17/h3-6,11,14H,7-10,12H2,1-2H3
InChIKeyISYWZQHUEPGTFI-UHFFFAOYSA-N
XLogP1.88
TPSA51.51 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.42
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (3-fluoro-4-methylphenyl)-[4-(3-methyl-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]methanone 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

N,N-Diethyl-4-{(4-ethyl-piperazin-1-yl)-[(Z)-phenylimino]-methyl}-benzamide
CID 10135151
N,N-Diethyl-4-{(4-ethyl-piperazin-1-yl)-[(Z)-2-fluoro-phenylimino]-methyl}-benzamide
CID 10158504
N,N-Diethyl-4-{(4-ethyl-piperazin-1-yl)-[(Z)-3-fluoro-phenylimino]-methyl}-benzamide
CID 10201643
4-{(4-Allyl-piperazin-1-yl)-[(Z)-phenylimino]-methyl}-N,N-diethyl-benzamide
CID 44293887
4-{((2S,5R)-4-Allyl-2,5-dimethyl-piperazin-1-yl)-[(Z)-phenylimino]-methyl}-N,N-diethyl-benzamide
CID 44294098
2-[(2S)-1-benzoylpiperidin-2-yl]-5,6-dimethyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 56597967
[4-[(4-Fluoropiperidin-1-yl)methyl]phenyl]-(4-propan-2-ylpiperazin-1-yl)methanone
CID 59218184
US10202354, Example 82
CID 121472714
US10202354, Example 84
CID 121477879
US10150767, Example 31
CID 137796663
US10150767, Example 26
CID 137796682
7-[[4-[4-(Trifluoromethyl)benzoyl]piperazin-1-yl]methyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 42893110

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-4-methylphenyl)-[4-(3-methyl-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]methanone?
The IUPAC name of (3-fluoro-4-methylphenyl)-[4-(3-methyl-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]methanone (CID 53184162) is (3-fluoro-4-methylphenyl)-[4-(3-methyl-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]methanone.
What is the SMILES notation for (3-fluoro-4-methylphenyl)-[4-(3-methyl-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]methanone?
The canonical SMILES for (3-fluoro-4-methylphenyl)-[4-(3-methyl-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]methanone is Cc1ccc(C(=O)N2CCN(C3=NC=CN4C3=NCC4C)CC2)cc1F.
What is the InChIKey of (3-fluoro-4-methylphenyl)-[4-(3-methyl-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]methanone?
The InChIKey is ISYWZQHUEPGTFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN5O/c1-13-3-4-15(11-16(13)20)19(26)24-9-7-23(8-10-24)17-18-22-12-14(2)25(18)6-5-21-17/h3-6,11,14H,7-10,12H2,1-2H3.
What are the key properties of (3-fluoro-4-methylphenyl)-[4-(3-methyl-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]methanone?
(3-fluoro-4-methylphenyl)-[4-(3-methyl-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]methanone has a molecular weight of 355.42 g/mol, XLogP of 1.88, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-4-methylphenyl)-[4-(3-methyl-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]methanone is sourced from PubChem (CID 53184162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).