4-(aminomethyl)-1-methylpyrazol-3-amine

C5H10N4 — CID 75480575

IUPAC4-(aminomethyl)-1-methylpyrazol-3-amine
SMILESCn1cc(CN)c(N)n1
InChIInChI=1S/C5H10N4/c1-9-3-4(2-6)5(7)8-9/h3H,2,6H2,1H3,(H2,7,8)
InChIKeyKJPISRZKUHMHMC-UHFFFAOYSA-N
MW126.16 g/mol
LogP-0.54
Rot. Bonds1

About 4-(aminomethyl)-1-methylpyrazol-3-amine

4-(aminomethyl)-1-methylpyrazol-3-amine (PubChem CID 75480575) has the molecular formula C5H10N4 and a molecular weight of 126.16 g/mol. Its IUPAC name is 4-(aminomethyl)-1-methylpyrazol-3-amine.

Molecular Properties

Compound Name4-(aminomethyl)-1-methylpyrazol-3-amine
PubChem CID75480575
Molecular FormulaC5H10N4
Molecular Weight126.16 g/mol
Exact Mass126.09
IUPAC Name4-(aminomethyl)-1-methylpyrazol-3-amine
SMILESCn1cc(CN)c(N)n1
InChIInChI=1S/C5H10N4/c1-9-3-4(2-6)5(7)8-9/h3H,2,6H2,1H3,(H2,7,8)
InChIKeyKJPISRZKUHMHMC-UHFFFAOYSA-N
XLogP-0.54
TPSA69.86 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 5-0.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-1-methylpyrazol-3-amine?
The IUPAC name of 4-(aminomethyl)-1-methylpyrazol-3-amine (CID 75480575) is 4-(aminomethyl)-1-methylpyrazol-3-amine.
What is the SMILES notation for 4-(aminomethyl)-1-methylpyrazol-3-amine?
The canonical SMILES for 4-(aminomethyl)-1-methylpyrazol-3-amine is Cn1cc(CN)c(N)n1.
What is the InChIKey of 4-(aminomethyl)-1-methylpyrazol-3-amine?
The InChIKey is KJPISRZKUHMHMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N4/c1-9-3-4(2-6)5(7)8-9/h3H,2,6H2,1H3,(H2,7,8).
What are the key properties of 4-(aminomethyl)-1-methylpyrazol-3-amine?
4-(aminomethyl)-1-methylpyrazol-3-amine has a molecular weight of 126.16 g/mol, XLogP of -0.54, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-1-methylpyrazol-3-amine is sourced from PubChem (CID 75480575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).