(4-methyl-2-phenylpiperazin-1-yl)-pyrazin-2-ylmethanone

C16H18N4O — CID 51251944

IUPAC(4-methyl-2-phenylpiperazin-1-yl)-pyrazin-2-ylmethanone
SMILESCN1CCN(C(=O)c2cnccn2)C(c2ccccc2)C1
InChIInChI=1S/C16H18N4O/c1-19-9-10-20(16(21)14-11-17-7-8-18-14)15(12-19)13-5-3-2-4-6-13/h2-8,11,15H,9-10,12H2,1H3
InChIKeySJEHMYFJCKBNQQ-UHFFFAOYSA-N
MW282.35 g/mol
LogP1.61
Rot. Bonds2

About (4-methyl-2-phenylpiperazin-1-yl)-pyrazin-2-ylmethanone

(4-methyl-2-phenylpiperazin-1-yl)-pyrazin-2-ylmethanone (PubChem CID 51251944) has the molecular formula C16H18N4O and a molecular weight of 282.35 g/mol. Its IUPAC name is (4-methyl-2-phenylpiperazin-1-yl)-pyrazin-2-ylmethanone.

Molecular Properties

Compound Name(4-methyl-2-phenylpiperazin-1-yl)-pyrazin-2-ylmethanone
PubChem CID51251944
Molecular FormulaC16H18N4O
Molecular Weight282.35 g/mol
Exact Mass282.15
IUPAC Name(4-methyl-2-phenylpiperazin-1-yl)-pyrazin-2-ylmethanone
SMILESCN1CCN(C(=O)c2cnccn2)C(c2ccccc2)C1
InChIInChI=1S/C16H18N4O/c1-19-9-10-20(16(21)14-11-17-7-8-18-14)15(12-19)13-5-3-2-4-6-13/h2-8,11,15H,9-10,12H2,1H3
InChIKeySJEHMYFJCKBNQQ-UHFFFAOYSA-N
XLogP1.61
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (4-methyl-2-phenylpiperazin-1-yl)-pyrazin-2-ylmethanone 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

1-[(3S)-3-phenyl-4-(pyrazine-2-carbonyl)piperazin-1-yl]ethanone
CID 124951880
(4-methyl-2-phenylpiperazin-1-yl)-phenylmethanone
CID 4069484
(5-cyclopropyl-1,2-oxazol-3-yl)-[(2S)-4-methyl-2-phenylpiperazin-1-yl]methanone
CID 34229533
(4-methyl-2-phenylpiperazin-1-yl)-(2-phenyltriazol-4-yl)methanone
CID 51266707
(2-anilinopyrimidin-5-yl)-[(2S)-4-methyl-2-phenylpiperazin-1-yl]methanone
CID 97156878
(2-hydroxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone
CID 43824710
(6-methoxy-3-pyridinyl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone
CID 37333871
(4-methyl-2-phenylpiperazin-1-yl)-(2-propyl-1,3-thiazol-4-yl)methanone
CID 72938463
(5-methyl-1,3-oxazol-4-yl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone
CID 129381205
(4-methyl-2-phenylpiperazin-1-yl)-(2-thiophen-3-yl-1,3-thiazol-4-yl)methanone
CID 51266752
(4-fluorophenyl)-[(2S)-4-methyl-2-phenylpiperazin-1-yl]methanone
CID 37332392
(2,6-dichloro-3-pyridinyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone
CID 167526074

Frequently Asked Questions

What is the IUPAC name of (4-methyl-2-phenylpiperazin-1-yl)-pyrazin-2-ylmethanone?
The IUPAC name of (4-methyl-2-phenylpiperazin-1-yl)-pyrazin-2-ylmethanone (CID 51251944) is (4-methyl-2-phenylpiperazin-1-yl)-pyrazin-2-ylmethanone.
What is the SMILES notation for (4-methyl-2-phenylpiperazin-1-yl)-pyrazin-2-ylmethanone?
The canonical SMILES for (4-methyl-2-phenylpiperazin-1-yl)-pyrazin-2-ylmethanone is CN1CCN(C(=O)c2cnccn2)C(c2ccccc2)C1.
What is the InChIKey of (4-methyl-2-phenylpiperazin-1-yl)-pyrazin-2-ylmethanone?
The InChIKey is SJEHMYFJCKBNQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O/c1-19-9-10-20(16(21)14-11-17-7-8-18-14)15(12-19)13-5-3-2-4-6-13/h2-8,11,15H,9-10,12H2,1H3.
What are the key properties of (4-methyl-2-phenylpiperazin-1-yl)-pyrazin-2-ylmethanone?
(4-methyl-2-phenylpiperazin-1-yl)-pyrazin-2-ylmethanone has a molecular weight of 282.35 g/mol, XLogP of 1.61, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-2-phenylpiperazin-1-yl)-pyrazin-2-ylmethanone is sourced from PubChem (CID 51251944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).