1-ethyl-3-methyl-5-propylpyrazol-4-amine

C9H17N3 — CID 130537699

IUPAC1-ethyl-3-methyl-5-propylpyrazol-4-amine
SMILESCCCc1c(N)c(C)nn1CC
InChIInChI=1S/C9H17N3/c1-4-6-8-9(10)7(3)11-12(8)5-2/h4-6,10H2,1-3H3
InChIKeyFCEOGORNXFUFRD-UHFFFAOYSA-N
MW167.26 g/mol
LogP1.75
Rot. Bonds3

About 1-ethyl-3-methyl-5-propylpyrazol-4-amine

1-ethyl-3-methyl-5-propylpyrazol-4-amine (PubChem CID 130537699) has the molecular formula C9H17N3 and a molecular weight of 167.26 g/mol. Its IUPAC name is 1-ethyl-3-methyl-5-propylpyrazol-4-amine.

Molecular Properties

Compound Name1-ethyl-3-methyl-5-propylpyrazol-4-amine
PubChem CID130537699
Molecular FormulaC9H17N3
Molecular Weight167.26 g/mol
Exact Mass167.14
IUPAC Name1-ethyl-3-methyl-5-propylpyrazol-4-amine
SMILESCCCc1c(N)c(C)nn1CC
InChIInChI=1S/C9H17N3/c1-4-6-8-9(10)7(3)11-12(8)5-2/h4-6,10H2,1-3H3
InChIKeyFCEOGORNXFUFRD-UHFFFAOYSA-N
XLogP1.75
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.26
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-methyl-5-propylpyrazol-4-amine?
The IUPAC name of 1-ethyl-3-methyl-5-propylpyrazol-4-amine (CID 130537699) is 1-ethyl-3-methyl-5-propylpyrazol-4-amine.
What is the SMILES notation for 1-ethyl-3-methyl-5-propylpyrazol-4-amine?
The canonical SMILES for 1-ethyl-3-methyl-5-propylpyrazol-4-amine is CCCc1c(N)c(C)nn1CC.
What is the InChIKey of 1-ethyl-3-methyl-5-propylpyrazol-4-amine?
The InChIKey is FCEOGORNXFUFRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3/c1-4-6-8-9(10)7(3)11-12(8)5-2/h4-6,10H2,1-3H3.
What are the key properties of 1-ethyl-3-methyl-5-propylpyrazol-4-amine?
1-ethyl-3-methyl-5-propylpyrazol-4-amine has a molecular weight of 167.26 g/mol, XLogP of 1.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-methyl-5-propylpyrazol-4-amine is sourced from PubChem (CID 130537699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).