3-N,3-N-dimethyl-1-(2-methylphenyl)pyrazole-3,5-diamine

C12H16N4 — CID 83864038

IUPAC3-N,3-N-dimethyl-1-(2-methylphenyl)pyrazole-3,5-diamine
SMILESCc1ccccc1-n1nc(N(C)C)cc1N
InChIInChI=1S/C12H16N4/c1-9-6-4-5-7-10(9)16-11(13)8-12(14-16)15(2)3/h4-8H,13H2,1-3H3
InChIKeyJZGRPFOHSCRIGH-UHFFFAOYSA-N
MW216.29 g/mol
LogP1.83
Rot. Bonds2

About 3-N,3-N-dimethyl-1-(2-methylphenyl)pyrazole-3,5-diamine

3-N,3-N-dimethyl-1-(2-methylphenyl)pyrazole-3,5-diamine (PubChem CID 83864038) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is 3-N,3-N-dimethyl-1-(2-methylphenyl)pyrazole-3,5-diamine.

Molecular Properties

Compound Name3-N,3-N-dimethyl-1-(2-methylphenyl)pyrazole-3,5-diamine
PubChem CID83864038
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Name3-N,3-N-dimethyl-1-(2-methylphenyl)pyrazole-3,5-diamine
SMILESCc1ccccc1-n1nc(N(C)C)cc1N
InChIInChI=1S/C12H16N4/c1-9-6-4-5-7-10(9)16-11(13)8-12(14-16)15(2)3/h4-8H,13H2,1-3H3
InChIKeyJZGRPFOHSCRIGH-UHFFFAOYSA-N
XLogP1.83
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,N,5-trimethyl-1-(2-methylphenyl)pyrazol-3-amine
CID 116817637
1-(2-methylphenyl)-3-(3-methylphenyl)pyrazol-5-amine
CID 4598830
3-cyclohexyl-1-(2-methylphenyl)pyrazol-5-amine
CID 82088784
1-(2-methylphenyl)-3-(pyrrolidin-1-ylmethyl)pyrazol-5-amine
CID 82171777
5-methyl-2-(2-methylphenyl)triazol-4-amine
CID 97058283
3-bromo-5-methyl-1-(2-methylphenyl)pyrazole
CID 59022551
2-[2-(aminomethyl)phenyl]-5-methylpyrazol-3-amine
CID 84776867
4-(aminomethyl)-1-(2-methylphenyl)pyrazole-3,5-diamine
CID 115056348
3-methyl-1-(2-methylphenyl)-4-quinoxalin-6-ylpyrazol-5-amine
CID 59286240
5-chloro-3-methyl-1-(2-methylphenyl)pyrazole-4-sulfonyl chloride
CID 82918290
4-(2-aminoethyl)-1-(2-methylphenyl)pyrazole-3,5-diamine
CID 115056349
[5-(4-fluorophenyl)-1-(2-methylphenyl)pyrazol-3-yl]methanamine
CID 82072215

Frequently Asked Questions

What is the IUPAC name of 3-N,3-N-dimethyl-1-(2-methylphenyl)pyrazole-3,5-diamine?
The IUPAC name of 3-N,3-N-dimethyl-1-(2-methylphenyl)pyrazole-3,5-diamine (CID 83864038) is 3-N,3-N-dimethyl-1-(2-methylphenyl)pyrazole-3,5-diamine.
What is the SMILES notation for 3-N,3-N-dimethyl-1-(2-methylphenyl)pyrazole-3,5-diamine?
The canonical SMILES for 3-N,3-N-dimethyl-1-(2-methylphenyl)pyrazole-3,5-diamine is Cc1ccccc1-n1nc(N(C)C)cc1N.
What is the InChIKey of 3-N,3-N-dimethyl-1-(2-methylphenyl)pyrazole-3,5-diamine?
The InChIKey is JZGRPFOHSCRIGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c1-9-6-4-5-7-10(9)16-11(13)8-12(14-16)15(2)3/h4-8H,13H2,1-3H3.
What are the key properties of 3-N,3-N-dimethyl-1-(2-methylphenyl)pyrazole-3,5-diamine?
3-N,3-N-dimethyl-1-(2-methylphenyl)pyrazole-3,5-diamine has a molecular weight of 216.29 g/mol, XLogP of 1.83, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,3-N-dimethyl-1-(2-methylphenyl)pyrazole-3,5-diamine is sourced from PubChem (CID 83864038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).