5-N-(3,5-dimethylphenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine

C15H22N4 — CID 66026960

IUPAC5-N-(3,5-dimethylphenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine
SMILESCc1cc(C)cc(Nc2c(N)c(C)nn2C(C)C)c1
InChIInChI=1S/C15H22N4/c1-9(2)19-15(14(16)12(5)18-19)17-13-7-10(3)6-11(4)8-13/h6-9,17H,16H2,1-5H3
InChIKeyPIRJXPXEZKZEPP-UHFFFAOYSA-N
MW258.37 g/mol
LogP3.72
Rot. Bonds3

About 5-N-(3,5-dimethylphenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine

5-N-(3,5-dimethylphenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine (PubChem CID 66026960) has the molecular formula C15H22N4 and a molecular weight of 258.37 g/mol. Its IUPAC name is 5-N-(3,5-dimethylphenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine.

Molecular Properties

Compound Name5-N-(3,5-dimethylphenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine
PubChem CID66026960
Molecular FormulaC15H22N4
Molecular Weight258.37 g/mol
Exact Mass258.18
IUPAC Name5-N-(3,5-dimethylphenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine
SMILESCc1cc(C)cc(Nc2c(N)c(C)nn2C(C)C)c1
InChIInChI=1S/C15H22N4/c1-9(2)19-15(14(16)12(5)18-19)17-13-7-10(3)6-11(4)8-13/h6-9,17H,16H2,1-5H3
InChIKeyPIRJXPXEZKZEPP-UHFFFAOYSA-N
XLogP3.72
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-N-(3,5-dimethylphenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine 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

5-N-(3,5-dichloro-4-fluorophenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine
CID 107571588
5-N-(3-bromo-5-methoxyphenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine
CID 82857326
3-[(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)amino]benzonitrile
CID 66029081
5-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine
CID 66028114
5-N-(4-ethoxyphenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine
CID 66029657
5-N-(3,5-dimethylphenyl)-3-methyl-1-propylpyrazole-4,5-diamine
CID 66029347
5-N-(2-bromo-5-chlorophenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine
CID 81262048
5-N-(2,4-difluorophenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine
CID 66026959
5-N-(1-ethylpyrazol-3-yl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine
CID 114251469
5-N-tert-butyl-3-methyl-1-propan-2-ylpyrazole-4,5-diamine
CID 66028498
1-[(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)amino]ethanol
CID 70039786
2-[(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)amino]-4-bromobenzonitrile
CID 107797167

Frequently Asked Questions

What is the IUPAC name of 5-N-(3,5-dimethylphenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine?
The IUPAC name of 5-N-(3,5-dimethylphenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine (CID 66026960) is 5-N-(3,5-dimethylphenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine.
What is the SMILES notation for 5-N-(3,5-dimethylphenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine?
The canonical SMILES for 5-N-(3,5-dimethylphenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine is Cc1cc(C)cc(Nc2c(N)c(C)nn2C(C)C)c1.
What is the InChIKey of 5-N-(3,5-dimethylphenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine?
The InChIKey is PIRJXPXEZKZEPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4/c1-9(2)19-15(14(16)12(5)18-19)17-13-7-10(3)6-11(4)8-13/h6-9,17H,16H2,1-5H3.
What are the key properties of 5-N-(3,5-dimethylphenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine?
5-N-(3,5-dimethylphenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine has a molecular weight of 258.37 g/mol, XLogP of 3.72, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(3,5-dimethylphenyl)-3-methyl-1-propan-2-ylpyrazole-4,5-diamine is sourced from PubChem (CID 66026960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).