1-[3-(3,4-dimethylphenyl)-1-methylpyrazol-4-yl]-N-methylmethanamine

C14H19N3 — CID 39096758

IUPAC1-[3-(3,4-dimethylphenyl)-1-methylpyrazol-4-yl]-N-methylmethanamine
SMILESCNCc1cn(C)nc1-c1ccc(C)c(C)c1
InChIInChI=1S/C14H19N3/c1-10-5-6-12(7-11(10)2)14-13(8-15-3)9-17(4)16-14/h5-7,9,15H,8H2,1-4H3
InChIKeyLFPDNPAIBBTGDG-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.42
Rot. Bonds3

About 1-[3-(3,4-dimethylphenyl)-1-methylpyrazol-4-yl]-N-methylmethanamine

1-[3-(3,4-dimethylphenyl)-1-methylpyrazol-4-yl]-N-methylmethanamine (PubChem CID 39096758) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 1-[3-(3,4-dimethylphenyl)-1-methylpyrazol-4-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-(3,4-dimethylphenyl)-1-methylpyrazol-4-yl]-N-methylmethanamine
PubChem CID39096758
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name1-[3-(3,4-dimethylphenyl)-1-methylpyrazol-4-yl]-N-methylmethanamine
SMILESCNCc1cn(C)nc1-c1ccc(C)c(C)c1
InChIInChI=1S/C14H19N3/c1-10-5-6-12(7-11(10)2)14-13(8-15-3)9-17(4)16-14/h5-7,9,15H,8H2,1-4H3
InChIKeyLFPDNPAIBBTGDG-UHFFFAOYSA-N
XLogP2.42
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[3-(3,4-dimethylphenyl)-1-methylpyrazol-4-yl]-N-methylmethanamine 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-[3-(4-chlorophenyl)-1-methylpyrazol-4-yl]-N-methylmethanamine
CID 39096770
1-[3-(4-ethylphenyl)-1-methylpyrazol-4-yl]-N-methylmethanamine
CID 39096752
N-[[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methylpyrazol-4-yl]methyl]-3,4-dimethylaniline
CID 78895190
1-[3-(3-fluoro-4-methylsulfonylphenyl)-1-methylpyrazol-4-yl]-N-methylmethanamine
CID 79484620
3-(3,4-dimethylphenyl)-1-methylpyrazole-4-carbothioamide
CID 39096372
N,N-dimethyl-2-[4-[1-methyl-4-(methylaminomethyl)pyrazol-3-yl]phenoxy]ethanamine
CID 79490898
N-[[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methylpyrazol-4-yl]methyl]propan-1-amine
CID 34748017
6-(3,4-dimethylphenyl)-4-(methylaminomethyl)-2-propylpyridazin-3-one
CID 82446687
1-[2-(3,4-dimethylphenyl)-4,5-dimethoxyphenyl]-N-methylmethanamine
CID 61032532
N-[[3-(4-chlorophenyl)-1-methylpyrazol-4-yl]methyl]propan-1-amine
CID 79485212
N-[[3-(4-bromophenyl)-1-methylpyrazol-4-yl]methyl]propan-1-amine
CID 79484462
1-(4-methylphenyl)-N-[(1-methyl-3-pyridin-4-ylpyrazol-4-yl)methyl]methanamine
CID 47610762

Frequently Asked Questions

What is the IUPAC name of 1-[3-(3,4-dimethylphenyl)-1-methylpyrazol-4-yl]-N-methylmethanamine?
The IUPAC name of 1-[3-(3,4-dimethylphenyl)-1-methylpyrazol-4-yl]-N-methylmethanamine (CID 39096758) is 1-[3-(3,4-dimethylphenyl)-1-methylpyrazol-4-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-(3,4-dimethylphenyl)-1-methylpyrazol-4-yl]-N-methylmethanamine?
The canonical SMILES for 1-[3-(3,4-dimethylphenyl)-1-methylpyrazol-4-yl]-N-methylmethanamine is CNCc1cn(C)nc1-c1ccc(C)c(C)c1.
What is the InChIKey of 1-[3-(3,4-dimethylphenyl)-1-methylpyrazol-4-yl]-N-methylmethanamine?
The InChIKey is LFPDNPAIBBTGDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-10-5-6-12(7-11(10)2)14-13(8-15-3)9-17(4)16-14/h5-7,9,15H,8H2,1-4H3.
What are the key properties of 1-[3-(3,4-dimethylphenyl)-1-methylpyrazol-4-yl]-N-methylmethanamine?
1-[3-(3,4-dimethylphenyl)-1-methylpyrazol-4-yl]-N-methylmethanamine has a molecular weight of 229.33 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(3,4-dimethylphenyl)-1-methylpyrazol-4-yl]-N-methylmethanamine is sourced from PubChem (CID 39096758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).