4-(aminomethyl)-1H-pyrazol-5-amine

C4H8N4 — CID 55255832

IUPAC4-(aminomethyl)-1H-pyrazol-5-amine
SMILESNCc1cn[nH]c1N
InChIInChI=1S/C4H8N4/c5-1-3-2-7-8-4(3)6/h2H,1,5H2,(H3,6,7,8)
InChIKeyHWODXVFEPPAJOA-UHFFFAOYSA-N
MW112.14 g/mol
LogP-0.55
Rot. Bonds1

About 4-(aminomethyl)-1H-pyrazol-5-amine

4-(aminomethyl)-1H-pyrazol-5-amine (PubChem CID 55255832) has the molecular formula C4H8N4 and a molecular weight of 112.14 g/mol. Its IUPAC name is 4-(aminomethyl)-1H-pyrazol-5-amine.

Molecular Properties

Compound Name4-(aminomethyl)-1H-pyrazol-5-amine
PubChem CID55255832
Molecular FormulaC4H8N4
Molecular Weight112.14 g/mol
Exact Mass112.07
IUPAC Name4-(aminomethyl)-1H-pyrazol-5-amine
SMILESNCc1cn[nH]c1N
InChIInChI=1S/C4H8N4/c5-1-3-2-7-8-4(3)6/h2H,1,5H2,(H3,6,7,8)
InChIKeyHWODXVFEPPAJOA-UHFFFAOYSA-N
XLogP-0.55
TPSA80.72 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.14
LogP ≤ 5-0.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-1H-pyrazol-5-amine?
The IUPAC name of 4-(aminomethyl)-1H-pyrazol-5-amine (CID 55255832) is 4-(aminomethyl)-1H-pyrazol-5-amine.
What is the SMILES notation for 4-(aminomethyl)-1H-pyrazol-5-amine?
The canonical SMILES for 4-(aminomethyl)-1H-pyrazol-5-amine is NCc1cn[nH]c1N.
What is the InChIKey of 4-(aminomethyl)-1H-pyrazol-5-amine?
The InChIKey is HWODXVFEPPAJOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N4/c5-1-3-2-7-8-4(3)6/h2H,1,5H2,(H3,6,7,8).
What are the key properties of 4-(aminomethyl)-1H-pyrazol-5-amine?
4-(aminomethyl)-1H-pyrazol-5-amine has a molecular weight of 112.14 g/mol, XLogP of -0.55, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-1H-pyrazol-5-amine is sourced from PubChem (CID 55255832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).