5-N,5-N-dimethyl-1-phenylpyrazole-3,5-diamine

C11H14N4 — CID 83864489

IUPAC5-N,5-N-dimethyl-1-phenylpyrazole-3,5-diamine
SMILESCN(C)c1cc(N)nn1-c1ccccc1
InChIInChI=1S/C11H14N4/c1-14(2)11-8-10(12)13-15(11)9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,12,13)
InChIKeyYUFDUJLDCVFNHM-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.52
Rot. Bonds2

About 5-N,5-N-dimethyl-1-phenylpyrazole-3,5-diamine

5-N,5-N-dimethyl-1-phenylpyrazole-3,5-diamine (PubChem CID 83864489) has the molecular formula C11H14N4 and a molecular weight of 202.26 g/mol. Its IUPAC name is 5-N,5-N-dimethyl-1-phenylpyrazole-3,5-diamine.

Molecular Properties

Compound Name5-N,5-N-dimethyl-1-phenylpyrazole-3,5-diamine
PubChem CID83864489
Molecular FormulaC11H14N4
Molecular Weight202.26 g/mol
Exact Mass202.12
IUPAC Name5-N,5-N-dimethyl-1-phenylpyrazole-3,5-diamine
SMILESCN(C)c1cc(N)nn1-c1ccccc1
InChIInChI=1S/C11H14N4/c1-14(2)11-8-10(12)13-15(11)9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,12,13)
InChIKeyYUFDUJLDCVFNHM-UHFFFAOYSA-N
XLogP1.52
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-N,5-N-dimethyl-1-phenylpyrazole-3,5-diamine?
The IUPAC name of 5-N,5-N-dimethyl-1-phenylpyrazole-3,5-diamine (CID 83864489) is 5-N,5-N-dimethyl-1-phenylpyrazole-3,5-diamine.
What is the SMILES notation for 5-N,5-N-dimethyl-1-phenylpyrazole-3,5-diamine?
The canonical SMILES for 5-N,5-N-dimethyl-1-phenylpyrazole-3,5-diamine is CN(C)c1cc(N)nn1-c1ccccc1.
What is the InChIKey of 5-N,5-N-dimethyl-1-phenylpyrazole-3,5-diamine?
The InChIKey is YUFDUJLDCVFNHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4/c1-14(2)11-8-10(12)13-15(11)9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,12,13).
What are the key properties of 5-N,5-N-dimethyl-1-phenylpyrazole-3,5-diamine?
5-N,5-N-dimethyl-1-phenylpyrazole-3,5-diamine has a molecular weight of 202.26 g/mol, XLogP of 1.52, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N,5-N-dimethyl-1-phenylpyrazole-3,5-diamine is sourced from PubChem (CID 83864489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).