4-methyl-2-pyrazin-2-yl-3,4-dihydropyrazol-5-amine

C8H11N5 — CID 83231950

IUPAC4-methyl-2-pyrazin-2-yl-3,4-dihydropyrazol-5-amine
SMILESCC1CN(c2cnccn2)N=C1N
InChIInChI=1S/C8H11N5/c1-6-5-13(12-8(6)9)7-4-10-2-3-11-7/h2-4,6H,5H2,1H3,(H2,9,12)
InChIKeyQQLRMHIDBAWXTD-UHFFFAOYSA-N
MW177.21 g/mol
LogP0.20
Rot. Bonds1

About 4-methyl-2-pyrazin-2-yl-3,4-dihydropyrazol-5-amine

4-methyl-2-pyrazin-2-yl-3,4-dihydropyrazol-5-amine (PubChem CID 83231950) has the molecular formula C8H11N5 and a molecular weight of 177.21 g/mol. Its IUPAC name is 4-methyl-2-pyrazin-2-yl-3,4-dihydropyrazol-5-amine.

Molecular Properties

Compound Name4-methyl-2-pyrazin-2-yl-3,4-dihydropyrazol-5-amine
PubChem CID83231950
Molecular FormulaC8H11N5
Molecular Weight177.21 g/mol
Exact Mass177.10
IUPAC Name4-methyl-2-pyrazin-2-yl-3,4-dihydropyrazol-5-amine
SMILESCC1CN(c2cnccn2)N=C1N
InChIInChI=1S/C8H11N5/c1-6-5-13(12-8(6)9)7-4-10-2-3-11-7/h2-4,6H,5H2,1H3,(H2,9,12)
InChIKeyQQLRMHIDBAWXTD-UHFFFAOYSA-N
XLogP0.20
TPSA67.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-pyrazin-2-yl-3,4-dihydropyrazol-5-amine?
The IUPAC name of 4-methyl-2-pyrazin-2-yl-3,4-dihydropyrazol-5-amine (CID 83231950) is 4-methyl-2-pyrazin-2-yl-3,4-dihydropyrazol-5-amine.
What is the SMILES notation for 4-methyl-2-pyrazin-2-yl-3,4-dihydropyrazol-5-amine?
The canonical SMILES for 4-methyl-2-pyrazin-2-yl-3,4-dihydropyrazol-5-amine is CC1CN(c2cnccn2)N=C1N.
What is the InChIKey of 4-methyl-2-pyrazin-2-yl-3,4-dihydropyrazol-5-amine?
The InChIKey is QQLRMHIDBAWXTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5/c1-6-5-13(12-8(6)9)7-4-10-2-3-11-7/h2-4,6H,5H2,1H3,(H2,9,12).
What are the key properties of 4-methyl-2-pyrazin-2-yl-3,4-dihydropyrazol-5-amine?
4-methyl-2-pyrazin-2-yl-3,4-dihydropyrazol-5-amine has a molecular weight of 177.21 g/mol, XLogP of 0.20, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-pyrazin-2-yl-3,4-dihydropyrazol-5-amine is sourced from PubChem (CID 83231950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).