4-methyl-1-propylpyrazol-5-amine

C7H13N3 — CID 1088345

IUPAC4-methyl-1-propylpyrazol-5-amine
SMILESCCCn1ncc(C)c1N
InChIInChI=1S/C7H13N3/c1-3-4-10-7(8)6(2)5-9-10/h5H,3-4,8H2,1-2H3
InChIKeyKUKRPMVQKPWSLT-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.18
Rot. Bonds2

About 4-methyl-1-propylpyrazol-5-amine

4-methyl-1-propylpyrazol-5-amine (PubChem CID 1088345) has the molecular formula C7H13N3 and a molecular weight of 139.20 g/mol. Its IUPAC name is 4-methyl-1-propylpyrazol-5-amine.

Molecular Properties

Compound Name4-methyl-1-propylpyrazol-5-amine
PubChem CID1088345
Molecular FormulaC7H13N3
Molecular Weight139.20 g/mol
Exact Mass139.11
IUPAC Name4-methyl-1-propylpyrazol-5-amine
SMILESCCCn1ncc(C)c1N
InChIInChI=1S/C7H13N3/c1-3-4-10-7(8)6(2)5-9-10/h5H,3-4,8H2,1-2H3
InChIKeyKUKRPMVQKPWSLT-UHFFFAOYSA-N
XLogP1.18
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 ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-propylpyrazol-5-amine?
The IUPAC name of 4-methyl-1-propylpyrazol-5-amine (CID 1088345) is 4-methyl-1-propylpyrazol-5-amine.
What is the SMILES notation for 4-methyl-1-propylpyrazol-5-amine?
The canonical SMILES for 4-methyl-1-propylpyrazol-5-amine is CCCn1ncc(C)c1N.
What is the InChIKey of 4-methyl-1-propylpyrazol-5-amine?
The InChIKey is KUKRPMVQKPWSLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3/c1-3-4-10-7(8)6(2)5-9-10/h5H,3-4,8H2,1-2H3.
What are the key properties of 4-methyl-1-propylpyrazol-5-amine?
4-methyl-1-propylpyrazol-5-amine has a molecular weight of 139.20 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-propylpyrazol-5-amine is sourced from PubChem (CID 1088345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).