N-[(2-methylphenyl)methyl]-1-(2-methylpyrazol-3-yl)ethanamine

C14H19N3 — CID 106757542

IUPACN-[(2-methylphenyl)methyl]-1-(2-methylpyrazol-3-yl)ethanamine
SMILESCc1ccccc1CNC(C)c1ccnn1C
InChIInChI=1S/C14H19N3/c1-11-6-4-5-7-13(11)10-15-12(2)14-8-9-16-17(14)3/h4-9,12,15H,10H2,1-3H3
InChIKeyGJYNPUMCAPVMGU-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.58
Rot. Bonds4

About N-[(2-methylphenyl)methyl]-1-(2-methylpyrazol-3-yl)ethanamine

N-[(2-methylphenyl)methyl]-1-(2-methylpyrazol-3-yl)ethanamine (PubChem CID 106757542) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is N-[(2-methylphenyl)methyl]-1-(2-methylpyrazol-3-yl)ethanamine.

Molecular Properties

Compound NameN-[(2-methylphenyl)methyl]-1-(2-methylpyrazol-3-yl)ethanamine
PubChem CID106757542
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC NameN-[(2-methylphenyl)methyl]-1-(2-methylpyrazol-3-yl)ethanamine
SMILESCc1ccccc1CNC(C)c1ccnn1C
InChIInChI=1S/C14H19N3/c1-11-6-4-5-7-13(11)10-15-12(2)14-8-9-16-17(14)3/h4-9,12,15H,10H2,1-3H3
InChIKeyGJYNPUMCAPVMGU-UHFFFAOYSA-N
XLogP2.58
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(2-methylphenyl)methyl]-1-(2-methylpyrazol-3-yl)ethanamine 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

N-benzyl-1-(2-methylpyrazol-3-yl)ethanamine
CID 106756794
1-(2-methylpyrazol-3-yl)-N-[(4-methylthiophen-3-yl)methyl]ethanamine
CID 106757924
(1S)-N-[[2-[4-[(dimethylamino)methyl]phenyl]phenyl]methyl]-1-(2-methylpyrazol-3-yl)ethanamine
CID 124624668
N'-[1-(2-methylpyrazol-3-yl)ethyl]ethane-1,2-diamine
CID 66657947
N-[1-(2-methylpyrazol-3-yl)ethyl]-3-phenylbutan-1-amine
CID 106757786
2,2-difluoro-N-[1-(2-methylpyrazol-3-yl)ethyl]ethanamine
CID 106757996
1-(2-methylpyrazol-3-yl)-N-(thiophen-3-ylmethyl)ethanamine
CID 106757796
N-[1-(2-methylpyrazol-3-yl)ethyl]-3-phenoxypropan-1-amine
CID 106757757
1-(2-methylpyrazol-3-yl)-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]ethanamine
CID 106757633
2-ethyl-N-[1-(2-methylpyrazol-3-yl)ethyl]butan-1-amine
CID 106758131
3,3,3-trifluoro-N-[1-(2-methylpyrazol-3-yl)ethyl]propan-1-amine
CID 106757793
2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]prop-2-en-1-amine
CID 106758152

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylphenyl)methyl]-1-(2-methylpyrazol-3-yl)ethanamine?
The IUPAC name of N-[(2-methylphenyl)methyl]-1-(2-methylpyrazol-3-yl)ethanamine (CID 106757542) is N-[(2-methylphenyl)methyl]-1-(2-methylpyrazol-3-yl)ethanamine.
What is the SMILES notation for N-[(2-methylphenyl)methyl]-1-(2-methylpyrazol-3-yl)ethanamine?
The canonical SMILES for N-[(2-methylphenyl)methyl]-1-(2-methylpyrazol-3-yl)ethanamine is Cc1ccccc1CNC(C)c1ccnn1C.
What is the InChIKey of N-[(2-methylphenyl)methyl]-1-(2-methylpyrazol-3-yl)ethanamine?
The InChIKey is GJYNPUMCAPVMGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-11-6-4-5-7-13(11)10-15-12(2)14-8-9-16-17(14)3/h4-9,12,15H,10H2,1-3H3.
What are the key properties of N-[(2-methylphenyl)methyl]-1-(2-methylpyrazol-3-yl)ethanamine?
N-[(2-methylphenyl)methyl]-1-(2-methylpyrazol-3-yl)ethanamine has a molecular weight of 229.33 g/mol, XLogP of 2.58, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylphenyl)methyl]-1-(2-methylpyrazol-3-yl)ethanamine is sourced from PubChem (CID 106757542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).