(3-aminopyrazin-2-yl)-[2-(3-fluorophenyl)piperazin-1-yl]methanone;dihydrochloride

C15H18Cl2FN5O — CID 120737871

IUPAC(3-aminopyrazin-2-yl)-[2-(3-fluorophenyl)piperazin-1-yl]methanone;dihydrochloride
SMILESCl.Cl.Nc1nccnc1C(=O)N1CCNCC1c1cccc(F)c1
InChIInChI=1S/C15H16FN5O.2ClH/c16-11-3-1-2-10(8-11)12-9-18-6-7-21(12)15(22)13-14(17)20-5-4-19-13;;/h1-5,8,12,18H,6-7,9H2,(H2,17,20);2*1H
InChIKeyXIHUCFNYZZJOGA-UHFFFAOYSA-N
MW374.25 g/mol
LogP1.83
Rot. Bonds2

About (3-aminopyrazin-2-yl)-[2-(3-fluorophenyl)piperazin-1-yl]methanone;dihydrochloride

(3-aminopyrazin-2-yl)-[2-(3-fluorophenyl)piperazin-1-yl]methanone;dihydrochloride (PubChem CID 120737871) has the molecular formula C15H18Cl2FN5O and a molecular weight of 374.25 g/mol. Its IUPAC name is (3-aminopyrazin-2-yl)-[2-(3-fluorophenyl)piperazin-1-yl]methanone;dihydrochloride.

Molecular Properties

Compound Name(3-aminopyrazin-2-yl)-[2-(3-fluorophenyl)piperazin-1-yl]methanone;dihydrochloride
PubChem CID120737871
Molecular FormulaC15H18Cl2FN5O
Molecular Weight374.25 g/mol
Exact Mass373.09
IUPAC Name(3-aminopyrazin-2-yl)-[2-(3-fluorophenyl)piperazin-1-yl]methanone;dihydrochloride
SMILESCl.Cl.Nc1nccnc1C(=O)N1CCNCC1c1cccc(F)c1
InChIInChI=1S/C15H16FN5O.2ClH/c16-11-3-1-2-10(8-11)12-9-18-6-7-21(12)15(22)13-14(17)20-5-4-19-13;;/h1-5,8,12,18H,6-7,9H2,(H2,17,20);2*1H
InChIKeyXIHUCFNYZZJOGA-UHFFFAOYSA-N
XLogP1.83
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.25
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (3-aminopyrazin-2-yl)-[2-(3-fluorophenyl)piperazin-1-yl]methanone;dihydrochloride 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

(3-aminopyrazin-2-yl)-(2-pyridin-3-ylpiperazin-1-yl)methanone
CID 120732345
[2-(3-fluorophenyl)piperazin-1-yl]-pyridin-2-ylmethanone
CID 120737504
(1,5-dimethyltriazol-4-yl)-[2-(3-fluorophenyl)piperazin-1-yl]methanone
CID 120737933
1-[4-[2-(3-fluorophenyl)piperazine-1-carbonyl]phenyl]imidazolidin-2-one;hydrochloride
CID 120736657
[2-(3-fluorophenyl)piperazin-1-yl]-(4-methylphenyl)methanone;hydrochloride
CID 120737441
5-[2-(3-fluorophenyl)piperazine-1-carbonyl]thiophene-2-carboxamide;hydrochloride
CID 120736543
(5-bromothiophen-3-yl)-[2-(3-fluorophenyl)piperazin-1-yl]methanone;hydrochloride
CID 120737625
[2-(3-fluorophenyl)piperazin-1-yl]-(5-methyl-1H-pyrazol-3-yl)methanone
CID 120736320
(3-aminopyrazin-2-yl)-[2-(2-methoxyphenyl)piperazin-1-yl]methanone;dihydrochloride
CID 120735210
[2-(3-fluorophenyl)piperazin-1-yl]-(3-methylthiophen-2-yl)methanone;hydrochloride
CID 120736765
(3,5-dimethylfuran-2-yl)-[2-(3-fluorophenyl)piperazin-1-yl]methanone;hydrochloride
CID 120737581
[2-(3-fluorophenyl)piperazin-1-yl]-(4-methylphenyl)methanone
CID 120737442

Frequently Asked Questions

What is the IUPAC name of (3-aminopyrazin-2-yl)-[2-(3-fluorophenyl)piperazin-1-yl]methanone;dihydrochloride?
The IUPAC name of (3-aminopyrazin-2-yl)-[2-(3-fluorophenyl)piperazin-1-yl]methanone;dihydrochloride (CID 120737871) is (3-aminopyrazin-2-yl)-[2-(3-fluorophenyl)piperazin-1-yl]methanone;dihydrochloride.
What is the SMILES notation for (3-aminopyrazin-2-yl)-[2-(3-fluorophenyl)piperazin-1-yl]methanone;dihydrochloride?
The canonical SMILES for (3-aminopyrazin-2-yl)-[2-(3-fluorophenyl)piperazin-1-yl]methanone;dihydrochloride is Cl.Cl.Nc1nccnc1C(=O)N1CCNCC1c1cccc(F)c1.
What is the InChIKey of (3-aminopyrazin-2-yl)-[2-(3-fluorophenyl)piperazin-1-yl]methanone;dihydrochloride?
The InChIKey is XIHUCFNYZZJOGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN5O.2ClH/c16-11-3-1-2-10(8-11)12-9-18-6-7-21(12)15(22)13-14(17)20-5-4-19-13;;/h1-5,8,12,18H,6-7,9H2,(H2,17,20);2*1H.
What are the key properties of (3-aminopyrazin-2-yl)-[2-(3-fluorophenyl)piperazin-1-yl]methanone;dihydrochloride?
(3-aminopyrazin-2-yl)-[2-(3-fluorophenyl)piperazin-1-yl]methanone;dihydrochloride has a molecular weight of 374.25 g/mol, XLogP of 1.83, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminopyrazin-2-yl)-[2-(3-fluorophenyl)piperazin-1-yl]methanone;dihydrochloride is sourced from PubChem (CID 120737871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).