1-methyl-4-[2-methyl-4-(6-methyl-3-pyridinyl)phenyl]piperazine

C18H23N3 — CID 144901537

IUPAC1-methyl-4-[2-methyl-4-(6-methyl-3-pyridinyl)phenyl]piperazine
SMILESCc1ccc(-c2ccc(N3CCN(C)CC3)c(C)c2)cn1
InChIInChI=1S/C18H23N3/c1-14-12-16(17-5-4-15(2)19-13-17)6-7-18(14)21-10-8-20(3)9-11-21/h4-7,12-13H,8-11H2,1-3H3
InChIKeyKKDULPFEZWSQCT-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.12
Rot. Bonds2

About 1-methyl-4-[2-methyl-4-(6-methyl-3-pyridinyl)phenyl]piperazine

1-methyl-4-[2-methyl-4-(6-methyl-3-pyridinyl)phenyl]piperazine (PubChem CID 144901537) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is 1-methyl-4-[2-methyl-4-(6-methyl-3-pyridinyl)phenyl]piperazine.

Molecular Properties

Compound Name1-methyl-4-[2-methyl-4-(6-methyl-3-pyridinyl)phenyl]piperazine
PubChem CID144901537
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC Name1-methyl-4-[2-methyl-4-(6-methyl-3-pyridinyl)phenyl]piperazine
SMILESCc1ccc(-c2ccc(N3CCN(C)CC3)c(C)c2)cn1
InChIInChI=1S/C18H23N3/c1-14-12-16(17-5-4-15(2)19-13-17)6-7-18(14)21-10-8-20(3)9-11-21/h4-7,12-13H,8-11H2,1-3H3
InChIKeyKKDULPFEZWSQCT-UHFFFAOYSA-N
XLogP3.12
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-methyl-4-[2-methyl-4-(6-methyl-3-pyridinyl)phenyl]piperazine 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-[4-(4-iodo-1H-pyrrol-2-yl)-2-methylphenyl]-4-methylpiperazine
CID 175085659
3-(2,5-dimethylpyrimidin-4-yl)-5-[3-methyl-4-(4-methylpiperazin-1-yl)phenyl]-1H-pyrrolo[2,3-b]pyridine
CID 175089364
ethane;3-methyl-4-(4-methylpiperazin-1-yl)aniline
CID 170593153
hexane;1-methyl-6-(6-methyl-3-pyridinyl)-3,4-dihydro-2H-quinoline
CID 145091188
1-(4-methoxy-2-methylphenyl)-4-methylpiperazine
CID 21363831
3-methyl-4-(4-methylpiperazin-1-yl)benzoic acid
CID 62121474
5-[3-[3,5-bis[3-(6-methyl-3-pyridinyl)phenyl]phenyl]phenyl]-2-methylpyridine
CID 59412018
N-cyclopropyl-N-methyl-4-[5-[3-methyl-4-(4-methylpiperazin-1-yl)phenyl]-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide
CID 146274683
4,5-dimethyl-2-[5-[3-methyl-4-(4-methylpiperazin-1-yl)phenyl]-1H-pyrrolo[2,3-b]pyridin-3-yl]-1,3-oxazole;formamide
CID 175086328
1-[5-(chloromethyl)-2-methyl-4-pyridinyl]-4-methylpiperazine
CID 81238657
[4-[5-[3-methyl-4-(4-methylpiperazin-1-yl)phenyl]-1H-pyrrolo[2,3-b]pyridin-3-yl]phenyl]-(1,3-oxazolidin-3-yl)methanone
CID 146274855
N-[(1R)-1-[5-fluoro-2-(4-methylpiperazin-1-yl)phenyl]ethyl]-6-methylpyridine-3-carboxamide
CID 95689792

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-[2-methyl-4-(6-methyl-3-pyridinyl)phenyl]piperazine?
The IUPAC name of 1-methyl-4-[2-methyl-4-(6-methyl-3-pyridinyl)phenyl]piperazine (CID 144901537) is 1-methyl-4-[2-methyl-4-(6-methyl-3-pyridinyl)phenyl]piperazine.
What is the SMILES notation for 1-methyl-4-[2-methyl-4-(6-methyl-3-pyridinyl)phenyl]piperazine?
The canonical SMILES for 1-methyl-4-[2-methyl-4-(6-methyl-3-pyridinyl)phenyl]piperazine is Cc1ccc(-c2ccc(N3CCN(C)CC3)c(C)c2)cn1.
What is the InChIKey of 1-methyl-4-[2-methyl-4-(6-methyl-3-pyridinyl)phenyl]piperazine?
The InChIKey is KKDULPFEZWSQCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c1-14-12-16(17-5-4-15(2)19-13-17)6-7-18(14)21-10-8-20(3)9-11-21/h4-7,12-13H,8-11H2,1-3H3.
What are the key properties of 1-methyl-4-[2-methyl-4-(6-methyl-3-pyridinyl)phenyl]piperazine?
1-methyl-4-[2-methyl-4-(6-methyl-3-pyridinyl)phenyl]piperazine has a molecular weight of 281.40 g/mol, XLogP of 3.12, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-[2-methyl-4-(6-methyl-3-pyridinyl)phenyl]piperazine is sourced from PubChem (CID 144901537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).