(2-methylpiperazin-1-yl)-(3-pyrazin-2-yloxyphenyl)methanone

C16H18N4O2 — CID 119471763

IUPAC(2-methylpiperazin-1-yl)-(3-pyrazin-2-yloxyphenyl)methanone
SMILESCC1CNCCN1C(=O)c1cccc(Oc2cnccn2)c1
InChIInChI=1S/C16H18N4O2/c1-12-10-18-7-8-20(12)16(21)13-3-2-4-14(9-13)22-15-11-17-5-6-19-15/h2-6,9,11-12,18H,7-8,10H2,1H3
InChIKeyOOFPOYDZPZHEAA-UHFFFAOYSA-N
MW298.35 g/mol
LogP1.70
Rot. Bonds3

About (2-methylpiperazin-1-yl)-(3-pyrazin-2-yloxyphenyl)methanone

(2-methylpiperazin-1-yl)-(3-pyrazin-2-yloxyphenyl)methanone (PubChem CID 119471763) has the molecular formula C16H18N4O2 and a molecular weight of 298.35 g/mol. Its IUPAC name is (2-methylpiperazin-1-yl)-(3-pyrazin-2-yloxyphenyl)methanone.

Molecular Properties

Compound Name(2-methylpiperazin-1-yl)-(3-pyrazin-2-yloxyphenyl)methanone
PubChem CID119471763
Molecular FormulaC16H18N4O2
Molecular Weight298.35 g/mol
Exact Mass298.14
IUPAC Name(2-methylpiperazin-1-yl)-(3-pyrazin-2-yloxyphenyl)methanone
SMILESCC1CNCCN1C(=O)c1cccc(Oc2cnccn2)c1
InChIInChI=1S/C16H18N4O2/c1-12-10-18-7-8-20(12)16(21)13-3-2-4-14(9-13)22-15-11-17-5-6-19-15/h2-6,9,11-12,18H,7-8,10H2,1H3
InChIKeyOOFPOYDZPZHEAA-UHFFFAOYSA-N
XLogP1.70
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2-methylpiperazin-1-yl)-(3-pyrazin-2-yloxyphenyl)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

(3-methoxyphenyl)-(2-methylpiperazin-1-yl)methanone
CID 51000391
(2-methylpiperazin-1-yl)-[3-(2-methylpropoxy)phenyl]methanone;hydrochloride
CID 119471460
(2S)-1-(3-pyrazin-2-yloxybenzoyl)pyrrolidine-2-carboxylic acid
CID 119366265
[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-(3-pyrazin-2-yloxyphenyl)methanone
CID 126783382
(2-methylpiperazin-1-yl)-pyrazin-2-ylmethanone;hydrochloride
CID 71639489
(3-fluorophenyl)-(2-methylpiperazin-1-yl)methanone
CID 62672072
[(2R)-2-methylpiperazin-1-yl]-quinolin-6-ylmethanone
CID 82705265
[(2S)-2-methylpiperazin-1-yl]-[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]methanone
CID 124571660
(2-methylpiperidin-1-yl)-(4-pyrazin-2-yloxyphenyl)methanone
CID 3778135
(3-fluorophenyl)-[(2S)-2-methylpiperazin-1-yl]methanone;hydrochloride
CID 68757495
sodium 3-[(2R)-2-methylpiperazine-1-carbonyl]benzoate
CID 126837861
(2-methylpiperazin-1-yl)-(4-phenoxyphenyl)methanone;hydrochloride
CID 119470393

Frequently Asked Questions

What is the IUPAC name of (2-methylpiperazin-1-yl)-(3-pyrazin-2-yloxyphenyl)methanone?
The IUPAC name of (2-methylpiperazin-1-yl)-(3-pyrazin-2-yloxyphenyl)methanone (CID 119471763) is (2-methylpiperazin-1-yl)-(3-pyrazin-2-yloxyphenyl)methanone.
What is the SMILES notation for (2-methylpiperazin-1-yl)-(3-pyrazin-2-yloxyphenyl)methanone?
The canonical SMILES for (2-methylpiperazin-1-yl)-(3-pyrazin-2-yloxyphenyl)methanone is CC1CNCCN1C(=O)c1cccc(Oc2cnccn2)c1.
What is the InChIKey of (2-methylpiperazin-1-yl)-(3-pyrazin-2-yloxyphenyl)methanone?
The InChIKey is OOFPOYDZPZHEAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O2/c1-12-10-18-7-8-20(12)16(21)13-3-2-4-14(9-13)22-15-11-17-5-6-19-15/h2-6,9,11-12,18H,7-8,10H2,1H3.
What are the key properties of (2-methylpiperazin-1-yl)-(3-pyrazin-2-yloxyphenyl)methanone?
(2-methylpiperazin-1-yl)-(3-pyrazin-2-yloxyphenyl)methanone has a molecular weight of 298.35 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpiperazin-1-yl)-(3-pyrazin-2-yloxyphenyl)methanone is sourced from PubChem (CID 119471763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).