N-methyl-4-(4-methylpiperazin-1-yl)-N-(pyrazin-2-ylmethyl)benzamide

C18H23N5O — CID 77082553

IUPACN-methyl-4-(4-methylpiperazin-1-yl)-N-(pyrazin-2-ylmethyl)benzamide
SMILESCN1CCN(c2ccc(C(=O)N(C)Cc3cnccn3)cc2)CC1
InChIInChI=1S/C18H23N5O/c1-21-9-11-23(12-10-21)17-5-3-15(4-6-17)18(24)22(2)14-16-13-19-7-8-20-16/h3-8,13H,9-12,14H2,1-2H3
InChIKeyYNUYIVBLMLOPIY-UHFFFAOYSA-N
MW325.42 g/mol
LogP1.50
Rot. Bonds4

About N-methyl-4-(4-methylpiperazin-1-yl)-N-(pyrazin-2-ylmethyl)benzamide

N-methyl-4-(4-methylpiperazin-1-yl)-N-(pyrazin-2-ylmethyl)benzamide (PubChem CID 77082553) has the molecular formula C18H23N5O and a molecular weight of 325.42 g/mol. Its IUPAC name is N-methyl-4-(4-methylpiperazin-1-yl)-N-(pyrazin-2-ylmethyl)benzamide.

Molecular Properties

Compound NameN-methyl-4-(4-methylpiperazin-1-yl)-N-(pyrazin-2-ylmethyl)benzamide
PubChem CID77082553
Molecular FormulaC18H23N5O
Molecular Weight325.42 g/mol
Exact Mass325.19
IUPAC NameN-methyl-4-(4-methylpiperazin-1-yl)-N-(pyrazin-2-ylmethyl)benzamide
SMILESCN1CCN(c2ccc(C(=O)N(C)Cc3cnccn3)cc2)CC1
InChIInChI=1S/C18H23N5O/c1-21-9-11-23(12-10-21)17-5-3-15(4-6-17)18(24)22(2)14-16-13-19-7-8-20-16/h3-8,13H,9-12,14H2,1-2H3
InChIKeyYNUYIVBLMLOPIY-UHFFFAOYSA-N
XLogP1.50
TPSA52.57 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.42
LogP ≤ 51.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-methyl-4-(4-methylpiperazin-1-yl)-N-(pyrazin-2-ylmethyl)benzamide 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-(Quinoxalin-6-ylcarbonyl)piperidine
CID 148184
Saruparib
CID 155586901
Piberaline
CID 65975
N-[1-(3-Methylbutyl)piperidin-4-Yl]-N-{4-[methyl(Pyridin-4-Yl)amino]benzyl}-4-Pentylbenzamide
CID 11214849
N-(2-aminophenyl)-4-{5-[(4-ethylpiperazin-1-yl)methyl]-3-methylpyridin-2-yl}benzamide
CID 11633344
4-[methyl(octyl)amino]-N-quinolin-3-ylbenzamide
CID 44450313
4-[hexyl(methyl)amino]-N-quinolin-3-ylbenzamide
CID 44450322
4-[butyl(methyl)amino]-N-quinolin-3-ylbenzamide
CID 44450336
N-(6-Oxo-1,6-Dihydro-3,4'-Bipyridin-5-Yl)-4-(Piperidin-1-Yl)benzamide
CID 52936434
5-[4-[(3-ethyl-2-oxidanylidene-1~{H}-quinolin-7-yl)methyl]piperazin-1-yl]-~{N}-methyl-pyridine-2-carboxamide
CID 156596360
(4-Isopropyl-piperazin-1-yl)-(6-piperidin-1-ylmethyl-pyridin-3-yl)-methanone
CID 11522780
(4-Isopropyl-piperazin-1-yl)-(5-piperidin-1-ylmethyl-pyridin-2-yl)-methanone
CID 25126154

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(4-methylpiperazin-1-yl)-N-(pyrazin-2-ylmethyl)benzamide?
The IUPAC name of N-methyl-4-(4-methylpiperazin-1-yl)-N-(pyrazin-2-ylmethyl)benzamide (CID 77082553) is N-methyl-4-(4-methylpiperazin-1-yl)-N-(pyrazin-2-ylmethyl)benzamide.
What is the SMILES notation for N-methyl-4-(4-methylpiperazin-1-yl)-N-(pyrazin-2-ylmethyl)benzamide?
The canonical SMILES for N-methyl-4-(4-methylpiperazin-1-yl)-N-(pyrazin-2-ylmethyl)benzamide is CN1CCN(c2ccc(C(=O)N(C)Cc3cnccn3)cc2)CC1.
What is the InChIKey of N-methyl-4-(4-methylpiperazin-1-yl)-N-(pyrazin-2-ylmethyl)benzamide?
The InChIKey is YNUYIVBLMLOPIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O/c1-21-9-11-23(12-10-21)17-5-3-15(4-6-17)18(24)22(2)14-16-13-19-7-8-20-16/h3-8,13H,9-12,14H2,1-2H3.
What are the key properties of N-methyl-4-(4-methylpiperazin-1-yl)-N-(pyrazin-2-ylmethyl)benzamide?
N-methyl-4-(4-methylpiperazin-1-yl)-N-(pyrazin-2-ylmethyl)benzamide has a molecular weight of 325.42 g/mol, XLogP of 1.50, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(4-methylpiperazin-1-yl)-N-(pyrazin-2-ylmethyl)benzamide is sourced from PubChem (CID 77082553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).