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

C7H13N3 — CID 29060602

IUPAC4-methyl-1-propan-2-ylpyrazol-5-amine
SMILESCc1cnn(C(C)C)c1N
InChIInChI=1S/C7H13N3/c1-5(2)10-7(8)6(3)4-9-10/h4-5H,8H2,1-3H3
InChIKeyJWPNXAXDFINCDT-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.35
Rot. Bonds1

About 4-methyl-1-propan-2-ylpyrazol-5-amine

4-methyl-1-propan-2-ylpyrazol-5-amine (PubChem CID 29060602) has the molecular formula C7H13N3 and a molecular weight of 139.20 g/mol. Its IUPAC name is 4-methyl-1-propan-2-ylpyrazol-5-amine.

Molecular Properties

Compound Name4-methyl-1-propan-2-ylpyrazol-5-amine
PubChem CID29060602
Molecular FormulaC7H13N3
Molecular Weight139.20 g/mol
Exact Mass139.11
IUPAC Name4-methyl-1-propan-2-ylpyrazol-5-amine
SMILESCc1cnn(C(C)C)c1N
InChIInChI=1S/C7H13N3/c1-5(2)10-7(8)6(3)4-9-10/h4-5H,8H2,1-3H3
InChIKeyJWPNXAXDFINCDT-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 4-methyl-1-propan-2-ylpyrazol-5-amine?
The IUPAC name of 4-methyl-1-propan-2-ylpyrazol-5-amine (CID 29060602) is 4-methyl-1-propan-2-ylpyrazol-5-amine.
What is the SMILES notation for 4-methyl-1-propan-2-ylpyrazol-5-amine?
The canonical SMILES for 4-methyl-1-propan-2-ylpyrazol-5-amine is Cc1cnn(C(C)C)c1N.
What is the InChIKey of 4-methyl-1-propan-2-ylpyrazol-5-amine?
The InChIKey is JWPNXAXDFINCDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3/c1-5(2)10-7(8)6(3)4-9-10/h4-5H,8H2,1-3H3.
What are the key properties of 4-methyl-1-propan-2-ylpyrazol-5-amine?
4-methyl-1-propan-2-ylpyrazol-5-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 4-methyl-1-propan-2-ylpyrazol-5-amine is sourced from PubChem (CID 29060602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).