2-(2-methylpropyl)pyrazol-3-amine

C7H13N3 — CID 4962021

IUPAC2-(2-methylpropyl)pyrazol-3-amine
SMILESCC(C)Cn1nccc1N
InChIInChI=1S/C7H13N3/c1-6(2)5-10-7(8)3-4-9-10/h3-4,6H,5,8H2,1-2H3
InChIKeyAGAFAORHXSFBGK-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.12
Rot. Bonds2

About 2-(2-methylpropyl)pyrazol-3-amine

2-(2-methylpropyl)pyrazol-3-amine (PubChem CID 4962021) has the molecular formula C7H13N3 and a molecular weight of 139.20 g/mol. Its IUPAC name is 2-(2-methylpropyl)pyrazol-3-amine.

Molecular Properties

Compound Name2-(2-methylpropyl)pyrazol-3-amine
PubChem CID4962021
Molecular FormulaC7H13N3
Molecular Weight139.20 g/mol
Exact Mass139.11
IUPAC Name2-(2-methylpropyl)pyrazol-3-amine
SMILESCC(C)Cn1nccc1N
InChIInChI=1S/C7H13N3/c1-6(2)5-10-7(8)3-4-9-10/h3-4,6H,5,8H2,1-2H3
InChIKeyAGAFAORHXSFBGK-UHFFFAOYSA-N
XLogP1.12
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpropyl)pyrazol-3-amine?
The IUPAC name of 2-(2-methylpropyl)pyrazol-3-amine (CID 4962021) is 2-(2-methylpropyl)pyrazol-3-amine.
What is the SMILES notation for 2-(2-methylpropyl)pyrazol-3-amine?
The canonical SMILES for 2-(2-methylpropyl)pyrazol-3-amine is CC(C)Cn1nccc1N.
What is the InChIKey of 2-(2-methylpropyl)pyrazol-3-amine?
The InChIKey is AGAFAORHXSFBGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3/c1-6(2)5-10-7(8)3-4-9-10/h3-4,6H,5,8H2,1-2H3.
What are the key properties of 2-(2-methylpropyl)pyrazol-3-amine?
2-(2-methylpropyl)pyrazol-3-amine has a molecular weight of 139.20 g/mol, XLogP of 1.12, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpropyl)pyrazol-3-amine is sourced from PubChem (CID 4962021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).