4-prop-1-enyl-1H-pyrazol-5-amine

C6H9N3 — CID 141406539

IUPAC4-prop-1-enyl-1H-pyrazol-5-amine
SMILESCC=Cc1cn[nH]c1N
InChIInChI=1S/C6H9N3/c1-2-3-5-4-8-9-6(5)7/h2-4H,1H3,(H3,7,8,9)
InChIKeyWANBOYFCDWXESW-UHFFFAOYSA-N
MW123.16 g/mol
LogP1.02
Rot. Bonds1

About 4-prop-1-enyl-1H-pyrazol-5-amine

4-prop-1-enyl-1H-pyrazol-5-amine (PubChem CID 141406539) has the molecular formula C6H9N3 and a molecular weight of 123.16 g/mol. Its IUPAC name is 4-prop-1-enyl-1H-pyrazol-5-amine.

Molecular Properties

Compound Name4-prop-1-enyl-1H-pyrazol-5-amine
PubChem CID141406539
Molecular FormulaC6H9N3
Molecular Weight123.16 g/mol
Exact Mass123.08
IUPAC Name4-prop-1-enyl-1H-pyrazol-5-amine
SMILESCC=Cc1cn[nH]c1N
InChIInChI=1S/C6H9N3/c1-2-3-5-4-8-9-6(5)7/h2-4H,1H3,(H3,7,8,9)
InChIKeyWANBOYFCDWXESW-UHFFFAOYSA-N
XLogP1.02
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.16
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-prop-1-enyl-1H-pyrazol-5-amine?
The IUPAC name of 4-prop-1-enyl-1H-pyrazol-5-amine (CID 141406539) is 4-prop-1-enyl-1H-pyrazol-5-amine.
What is the SMILES notation for 4-prop-1-enyl-1H-pyrazol-5-amine?
The canonical SMILES for 4-prop-1-enyl-1H-pyrazol-5-amine is CC=Cc1cn[nH]c1N.
What is the InChIKey of 4-prop-1-enyl-1H-pyrazol-5-amine?
The InChIKey is WANBOYFCDWXESW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3/c1-2-3-5-4-8-9-6(5)7/h2-4H,1H3,(H3,7,8,9).
What are the key properties of 4-prop-1-enyl-1H-pyrazol-5-amine?
4-prop-1-enyl-1H-pyrazol-5-amine has a molecular weight of 123.16 g/mol, XLogP of 1.02, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-prop-1-enyl-1H-pyrazol-5-amine is sourced from PubChem (CID 141406539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).