azane;(2,4,5-trimethylpyrazol-3-yl)methanamine

C7H16N4 — CID 68629515

IUPACazane;(2,4,5-trimethylpyrazol-3-yl)methanamine
SMILESCc1nn(C)c(CN)c1C.N
InChIInChI=1S/C7H13N3.H3N/c1-5-6(2)9-10(3)7(5)4-8;/h4,8H2,1-3H3;1H3
InChIKeyTUXALYFREFZTHI-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.66
Rot. Bonds1

About azane;(2,4,5-trimethylpyrazol-3-yl)methanamine

azane;(2,4,5-trimethylpyrazol-3-yl)methanamine (PubChem CID 68629515) has the molecular formula C7H16N4 and a molecular weight of 156.23 g/mol. Its IUPAC name is azane;(2,4,5-trimethylpyrazol-3-yl)methanamine.

Molecular Properties

Compound Nameazane;(2,4,5-trimethylpyrazol-3-yl)methanamine
PubChem CID68629515
Molecular FormulaC7H16N4
Molecular Weight156.23 g/mol
Exact Mass156.14
IUPAC Nameazane;(2,4,5-trimethylpyrazol-3-yl)methanamine
SMILESCc1nn(C)c(CN)c1C.N
InChIInChI=1S/C7H13N3.H3N/c1-5-6(2)9-10(3)7(5)4-8;/h4,8H2,1-3H3;1H3
InChIKeyTUXALYFREFZTHI-UHFFFAOYSA-N
XLogP0.66
TPSA78.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze azane;(2,4,5-trimethylpyrazol-3-yl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of azane;(2,4,5-trimethylpyrazol-3-yl)methanamine?
The IUPAC name of azane;(2,4,5-trimethylpyrazol-3-yl)methanamine (CID 68629515) is azane;(2,4,5-trimethylpyrazol-3-yl)methanamine.
What is the SMILES notation for azane;(2,4,5-trimethylpyrazol-3-yl)methanamine?
The canonical SMILES for azane;(2,4,5-trimethylpyrazol-3-yl)methanamine is Cc1nn(C)c(CN)c1C.N.
What is the InChIKey of azane;(2,4,5-trimethylpyrazol-3-yl)methanamine?
The InChIKey is TUXALYFREFZTHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3.H3N/c1-5-6(2)9-10(3)7(5)4-8;/h4,8H2,1-3H3;1H3.
What are the key properties of azane;(2,4,5-trimethylpyrazol-3-yl)methanamine?
azane;(2,4,5-trimethylpyrazol-3-yl)methanamine has a molecular weight of 156.23 g/mol, XLogP of 0.66, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azane;(2,4,5-trimethylpyrazol-3-yl)methanamine is sourced from PubChem (CID 68629515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).