5-methyl-1-propan-2-ylpyrazol-3-amine

C7H13N3 — CID 7176029

IUPAC5-methyl-1-propan-2-ylpyrazol-3-amine
SMILESCc1cc(N)nn1C(C)C
InChIInChI=1S/C7H13N3/c1-5(2)10-6(3)4-7(8)9-10/h4-5H,1-3H3,(H2,8,9)
InChIKeyYRVDRQBBMHLPLD-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.35
Rot. Bonds1

About 5-methyl-1-propan-2-ylpyrazol-3-amine

5-methyl-1-propan-2-ylpyrazol-3-amine (PubChem CID 7176029) has the molecular formula C7H13N3 and a molecular weight of 139.20 g/mol. Its IUPAC name is 5-methyl-1-propan-2-ylpyrazol-3-amine.

Molecular Properties

Compound Name5-methyl-1-propan-2-ylpyrazol-3-amine
PubChem CID7176029
Molecular FormulaC7H13N3
Molecular Weight139.20 g/mol
Exact Mass139.11
IUPAC Name5-methyl-1-propan-2-ylpyrazol-3-amine
SMILESCc1cc(N)nn1C(C)C
InChIInChI=1S/C7H13N3/c1-5(2)10-6(3)4-7(8)9-10/h4-5H,1-3H3,(H2,8,9)
InChIKeyYRVDRQBBMHLPLD-UHFFFAOYSA-N
XLogP1.35
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-propan-2-ylpyrazol-3-amine?
The IUPAC name of 5-methyl-1-propan-2-ylpyrazol-3-amine (CID 7176029) is 5-methyl-1-propan-2-ylpyrazol-3-amine.
What is the SMILES notation for 5-methyl-1-propan-2-ylpyrazol-3-amine?
The canonical SMILES for 5-methyl-1-propan-2-ylpyrazol-3-amine is Cc1cc(N)nn1C(C)C.
What is the InChIKey of 5-methyl-1-propan-2-ylpyrazol-3-amine?
The InChIKey is YRVDRQBBMHLPLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3/c1-5(2)10-6(3)4-7(8)9-10/h4-5H,1-3H3,(H2,8,9).
What are the key properties of 5-methyl-1-propan-2-ylpyrazol-3-amine?
5-methyl-1-propan-2-ylpyrazol-3-amine has a molecular weight of 139.20 g/mol, XLogP of 1.35, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-propan-2-ylpyrazol-3-amine is sourced from PubChem (CID 7176029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).