4-[6-[4-(2-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]-N,N-dimethylaniline

C23H27N5O — CID 6482829

IUPAC4-[6-[4-(2-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]-N,N-dimethylaniline
SMILESCOc1ccccc1N1CCN(c2cncc(-c3ccc(N(C)C)cc3)n2)CC1
InChIInChI=1S/C23H27N5O/c1-26(2)19-10-8-18(9-11-19)20-16-24-17-23(25-20)28-14-12-27(13-15-28)21-6-4-5-7-22(21)29-3/h4-11,16-17H,12-15H2,1-3H3
InChIKeyVLNWAWVITPQFQY-UHFFFAOYSA-N
MW389.50 g/mol
LogP3.54
Rot. Bonds5

About 4-[6-[4-(2-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]-N,N-dimethylaniline

4-[6-[4-(2-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]-N,N-dimethylaniline (PubChem CID 6482829) has the molecular formula C23H27N5O and a molecular weight of 389.50 g/mol. Its IUPAC name is 4-[6-[4-(2-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]-N,N-dimethylaniline.

Molecular Properties

Compound Name4-[6-[4-(2-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]-N,N-dimethylaniline
PubChem CID6482829
Molecular FormulaC23H27N5O
Molecular Weight389.50 g/mol
Exact Mass389.22
IUPAC Name4-[6-[4-(2-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]-N,N-dimethylaniline
SMILESCOc1ccccc1N1CCN(c2cncc(-c3ccc(N(C)C)cc3)n2)CC1
InChIInChI=1S/C23H27N5O/c1-26(2)19-10-8-18(9-11-19)20-16-24-17-23(25-20)28-14-12-27(13-15-28)21-6-4-5-7-22(21)29-3/h4-11,16-17H,12-15H2,1-3H3
InChIKeyVLNWAWVITPQFQY-UHFFFAOYSA-N
XLogP3.54
TPSA44.73 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.50
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-[6-[4-(2-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]-N,N-dimethylaniline 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 4-[6-[4-(2-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]-N,N-dimethylaniline?
The IUPAC name of 4-[6-[4-(2-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]-N,N-dimethylaniline (CID 6482829) is 4-[6-[4-(2-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]-N,N-dimethylaniline.
What is the SMILES notation for 4-[6-[4-(2-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]-N,N-dimethylaniline?
The canonical SMILES for 4-[6-[4-(2-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]-N,N-dimethylaniline is COc1ccccc1N1CCN(c2cncc(-c3ccc(N(C)C)cc3)n2)CC1.
What is the InChIKey of 4-[6-[4-(2-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]-N,N-dimethylaniline?
The InChIKey is VLNWAWVITPQFQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N5O/c1-26(2)19-10-8-18(9-11-19)20-16-24-17-23(25-20)28-14-12-27(13-15-28)21-6-4-5-7-22(21)29-3/h4-11,16-17H,12-15H2,1-3H3.
What are the key properties of 4-[6-[4-(2-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]-N,N-dimethylaniline?
4-[6-[4-(2-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]-N,N-dimethylaniline has a molecular weight of 389.50 g/mol, XLogP of 3.54, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-[4-(2-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]-N,N-dimethylaniline is sourced from PubChem (CID 6482829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).