1-(2-methylbutyl)pyrazol-3-amine

C8H15N3 — CID 62103459

IUPAC1-(2-methylbutyl)pyrazol-3-amine
SMILESCCC(C)Cn1ccc(N)n1
InChIInChI=1S/C8H15N3/c1-3-7(2)6-11-5-4-8(9)10-11/h4-5,7H,3,6H2,1-2H3,(H2,9,10)
InChIKeyQLRZIOOWGRTYSL-UHFFFAOYSA-N
MW153.23 g/mol
LogP1.51
Rot. Bonds3

About 1-(2-methylbutyl)pyrazol-3-amine

1-(2-methylbutyl)pyrazol-3-amine (PubChem CID 62103459) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is 1-(2-methylbutyl)pyrazol-3-amine.

Molecular Properties

Compound Name1-(2-methylbutyl)pyrazol-3-amine
PubChem CID62103459
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC Name1-(2-methylbutyl)pyrazol-3-amine
SMILESCCC(C)Cn1ccc(N)n1
InChIInChI=1S/C8H15N3/c1-3-7(2)6-11-5-4-8(9)10-11/h4-5,7H,3,6H2,1-2H3,(H2,9,10)
InChIKeyQLRZIOOWGRTYSL-UHFFFAOYSA-N
XLogP1.51
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylbutyl)pyrazol-3-amine?
The IUPAC name of 1-(2-methylbutyl)pyrazol-3-amine (CID 62103459) is 1-(2-methylbutyl)pyrazol-3-amine.
What is the SMILES notation for 1-(2-methylbutyl)pyrazol-3-amine?
The canonical SMILES for 1-(2-methylbutyl)pyrazol-3-amine is CCC(C)Cn1ccc(N)n1.
What is the InChIKey of 1-(2-methylbutyl)pyrazol-3-amine?
The InChIKey is QLRZIOOWGRTYSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-3-7(2)6-11-5-4-8(9)10-11/h4-5,7H,3,6H2,1-2H3,(H2,9,10).
What are the key properties of 1-(2-methylbutyl)pyrazol-3-amine?
1-(2-methylbutyl)pyrazol-3-amine has a molecular weight of 153.23 g/mol, XLogP of 1.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylbutyl)pyrazol-3-amine is sourced from PubChem (CID 62103459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).