1-methyl-N-[2-(4-methylphenyl)ethyl]pyrazol-3-amine

C13H17N3 — CID 75517812

IUPAC1-methyl-N-[2-(4-methylphenyl)ethyl]pyrazol-3-amine
SMILESCc1ccc(CCNc2ccn(C)n2)cc1
InChIInChI=1S/C13H17N3/c1-11-3-5-12(6-4-11)7-9-14-13-8-10-16(2)15-13/h3-6,8,10H,7,9H2,1-2H3,(H,14,15)
InChIKeyJOSPLTTYVNWJOK-UHFFFAOYSA-N
MW215.30 g/mol
LogP2.38
Rot. Bonds4

About 1-methyl-N-[2-(4-methylphenyl)ethyl]pyrazol-3-amine

1-methyl-N-[2-(4-methylphenyl)ethyl]pyrazol-3-amine (PubChem CID 75517812) has the molecular formula C13H17N3 and a molecular weight of 215.30 g/mol. Its IUPAC name is 1-methyl-N-[2-(4-methylphenyl)ethyl]pyrazol-3-amine.

Molecular Properties

Compound Name1-methyl-N-[2-(4-methylphenyl)ethyl]pyrazol-3-amine
PubChem CID75517812
Molecular FormulaC13H17N3
Molecular Weight215.30 g/mol
Exact Mass215.14
IUPAC Name1-methyl-N-[2-(4-methylphenyl)ethyl]pyrazol-3-amine
SMILESCc1ccc(CCNc2ccn(C)n2)cc1
InChIInChI=1S/C13H17N3/c1-11-3-5-12(6-4-11)7-9-14-13-8-10-16(2)15-13/h3-6,8,10H,7,9H2,1-2H3,(H,14,15)
InChIKeyJOSPLTTYVNWJOK-UHFFFAOYSA-N
XLogP2.38
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-methyl-N-[2-(4-methylphenyl)ethyl]pyrazol-3-amine 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-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-3-amine
CID 103001663
2-[(1-methylpyrazol-3-yl)amino]ethanol
CID 23443606
1-methyl-N-[2-[3-(trifluoromethyl)phenyl]ethyl]pyrazol-3-amine
CID 166246765
N-[2-[2-(aminomethyl)phenyl]ethyl]-1-methylpyrazol-3-amine
CID 103568727
2-methyl-4-[(1-methylpyrazol-3-yl)amino]butan-2-ol
CID 79779568
N'-(1-methylpyrazol-3-yl)hexane-1,6-diamine
CID 103568574
N-[(4-iodophenyl)methyl]-1-methylpyrazol-3-amine
CID 79778850
1-methyl-N-(2-propan-2-yloxyethyl)pyrazol-3-amine
CID 79779073
N-[(4-methylphenyl)methyl]-2-(1-methylpyrazol-3-yl)ethanamine
CID 104626931
1-methyl-N-[2-(4-methylphenyl)ethyl]-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120971314
[6-[2-(4-methylphenyl)ethylamino]pyrimidin-4-yl]cyanamide
CID 115264702
1-methyl-N-(2-phenylmethoxyethyl)pyrazol-3-amine
CID 130536838

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[2-(4-methylphenyl)ethyl]pyrazol-3-amine?
The IUPAC name of 1-methyl-N-[2-(4-methylphenyl)ethyl]pyrazol-3-amine (CID 75517812) is 1-methyl-N-[2-(4-methylphenyl)ethyl]pyrazol-3-amine.
What is the SMILES notation for 1-methyl-N-[2-(4-methylphenyl)ethyl]pyrazol-3-amine?
The canonical SMILES for 1-methyl-N-[2-(4-methylphenyl)ethyl]pyrazol-3-amine is Cc1ccc(CCNc2ccn(C)n2)cc1.
What is the InChIKey of 1-methyl-N-[2-(4-methylphenyl)ethyl]pyrazol-3-amine?
The InChIKey is JOSPLTTYVNWJOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3/c1-11-3-5-12(6-4-11)7-9-14-13-8-10-16(2)15-13/h3-6,8,10H,7,9H2,1-2H3,(H,14,15).
What are the key properties of 1-methyl-N-[2-(4-methylphenyl)ethyl]pyrazol-3-amine?
1-methyl-N-[2-(4-methylphenyl)ethyl]pyrazol-3-amine has a molecular weight of 215.30 g/mol, XLogP of 2.38, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[2-(4-methylphenyl)ethyl]pyrazol-3-amine is sourced from PubChem (CID 75517812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).