3-methyl-N-[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]benzamide

C24H26N4O — CID 113014298

IUPAC3-methyl-N-[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]benzamide
SMILESCc1cccc(C(=O)Nc2ccc(N3CCN(c4cccc(C)c4)CC3)nc2)c1
InChIInChI=1S/C24H26N4O/c1-18-5-3-7-20(15-18)24(29)26-21-9-10-23(25-17-21)28-13-11-27(12-14-28)22-8-4-6-19(2)16-22/h3-10,15-17H,11-14H2,1-2H3,(H,26,29)
InChIKeyRPRKIZPLRNJUDL-UHFFFAOYSA-N
MW386.50 g/mol
LogP4.28
Rot. Bonds4

About 3-methyl-N-[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]benzamide

3-methyl-N-[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]benzamide (PubChem CID 113014298) has the molecular formula C24H26N4O and a molecular weight of 386.50 g/mol. Its IUPAC name is 3-methyl-N-[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]benzamide.

Molecular Properties

Compound Name3-methyl-N-[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]benzamide
PubChem CID113014298
Molecular FormulaC24H26N4O
Molecular Weight386.50 g/mol
Exact Mass386.21
IUPAC Name3-methyl-N-[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]benzamide
SMILESCc1cccc(C(=O)Nc2ccc(N3CCN(c4cccc(C)c4)CC3)nc2)c1
InChIInChI=1S/C24H26N4O/c1-18-5-3-7-20(15-18)24(29)26-21-9-10-23(25-17-21)28-13-11-27(12-14-28)22-8-4-6-19(2)16-22/h3-10,15-17H,11-14H2,1-2H3,(H,26,29)
InChIKeyRPRKIZPLRNJUDL-UHFFFAOYSA-N
XLogP4.28
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-methyl-N-[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]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

ethyl 4-[5-[(3-methylbenzoyl)amino]-2-pyridinyl]piperazine-1-carboxylate
CID 113014225
2-amino-N-[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]acetamide
CID 39181745
3-methyl-N-[6-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-3-pyridinyl]benzamide
CID 46157259
N-[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]oxane-4-carboxamide
CID 113014312
3-methyl-N-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]benzamide
CID 121112848
N-cyclopentyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyridine-3-carboxamide
CID 109152244
[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]methanol
CID 61252606
N-[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]propane-1-sulfonamide
CID 113014317
3-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide;dihydrochloride
CID 119839707
N-[6-[4-(4-methylbenzoyl)piperazin-1-yl]-3-pyridinyl]benzamide
CID 42849983
3-methyl-N-[5-(4-pyridin-2-ylpiperazin-1-yl)-2-pyridinyl]benzamide
CID 113029571
3-(2-oxopyrrolidin-1-yl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)benzamide
CID 30217566

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]benzamide?
The IUPAC name of 3-methyl-N-[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]benzamide (CID 113014298) is 3-methyl-N-[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]benzamide.
What is the SMILES notation for 3-methyl-N-[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]benzamide?
The canonical SMILES for 3-methyl-N-[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]benzamide is Cc1cccc(C(=O)Nc2ccc(N3CCN(c4cccc(C)c4)CC3)nc2)c1.
What is the InChIKey of 3-methyl-N-[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]benzamide?
The InChIKey is RPRKIZPLRNJUDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O/c1-18-5-3-7-20(15-18)24(29)26-21-9-10-23(25-17-21)28-13-11-27(12-14-28)22-8-4-6-19(2)16-22/h3-10,15-17H,11-14H2,1-2H3,(H,26,29).
What are the key properties of 3-methyl-N-[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]benzamide?
3-methyl-N-[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]benzamide has a molecular weight of 386.50 g/mol, XLogP of 4.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]benzamide is sourced from PubChem (CID 113014298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).