3,5-diethyl-1H-pyrazol-4-amine

C7H13N3 — CID 82692249

IUPAC3,5-diethyl-1H-pyrazol-4-amine
SMILESCCc1n[nH]c(CC)c1N
InChIInChI=1S/C7H13N3/c1-3-5-7(8)6(4-2)10-9-5/h3-4,8H2,1-2H3,(H,9,10)
InChIKeyIMBJNOJXJVXFSE-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.12
Rot. Bonds2

About 3,5-diethyl-1H-pyrazol-4-amine

3,5-diethyl-1H-pyrazol-4-amine (PubChem CID 82692249) has the molecular formula C7H13N3 and a molecular weight of 139.20 g/mol. Its IUPAC name is 3,5-diethyl-1H-pyrazol-4-amine.

Molecular Properties

Compound Name3,5-diethyl-1H-pyrazol-4-amine
PubChem CID82692249
Molecular FormulaC7H13N3
Molecular Weight139.20 g/mol
Exact Mass139.11
IUPAC Name3,5-diethyl-1H-pyrazol-4-amine
SMILESCCc1n[nH]c(CC)c1N
InChIInChI=1S/C7H13N3/c1-3-5-7(8)6(4-2)10-9-5/h3-4,8H2,1-2H3,(H,9,10)
InChIKeyIMBJNOJXJVXFSE-UHFFFAOYSA-N
XLogP1.12
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,5-diethyl-1H-pyrazol-4-amine?
The IUPAC name of 3,5-diethyl-1H-pyrazol-4-amine (CID 82692249) is 3,5-diethyl-1H-pyrazol-4-amine.
What is the SMILES notation for 3,5-diethyl-1H-pyrazol-4-amine?
The canonical SMILES for 3,5-diethyl-1H-pyrazol-4-amine is CCc1n[nH]c(CC)c1N.
What is the InChIKey of 3,5-diethyl-1H-pyrazol-4-amine?
The InChIKey is IMBJNOJXJVXFSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3/c1-3-5-7(8)6(4-2)10-9-5/h3-4,8H2,1-2H3,(H,9,10).
What are the key properties of 3,5-diethyl-1H-pyrazol-4-amine?
3,5-diethyl-1H-pyrazol-4-amine has a molecular weight of 139.20 g/mol, XLogP of 1.12, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diethyl-1H-pyrazol-4-amine is sourced from PubChem (CID 82692249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).