3-(2-methylpyrazol-3-yl)-1-pyrazin-2-ylpropan-1-amine

C11H15N5 — CID 103009015

IUPAC3-(2-methylpyrazol-3-yl)-1-pyrazin-2-ylpropan-1-amine
SMILESCn1nccc1CCC(N)c1cnccn1
InChIInChI=1S/C11H15N5/c1-16-9(4-5-15-16)2-3-10(12)11-8-13-6-7-14-11/h4-8,10H,2-3,12H2,1H3
InChIKeyWVCKWYUOGUKWMH-UHFFFAOYSA-N
MW217.28 g/mol
LogP0.84
Rot. Bonds4

About 3-(2-methylpyrazol-3-yl)-1-pyrazin-2-ylpropan-1-amine

3-(2-methylpyrazol-3-yl)-1-pyrazin-2-ylpropan-1-amine (PubChem CID 103009015) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is 3-(2-methylpyrazol-3-yl)-1-pyrazin-2-ylpropan-1-amine.

Molecular Properties

Compound Name3-(2-methylpyrazol-3-yl)-1-pyrazin-2-ylpropan-1-amine
PubChem CID103009015
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC Name3-(2-methylpyrazol-3-yl)-1-pyrazin-2-ylpropan-1-amine
SMILESCn1nccc1CCC(N)c1cnccn1
InChIInChI=1S/C11H15N5/c1-16-9(4-5-15-16)2-3-10(12)11-8-13-6-7-14-11/h4-8,10H,2-3,12H2,1H3
InChIKeyWVCKWYUOGUKWMH-UHFFFAOYSA-N
XLogP0.84
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(2-methylpyrazol-3-yl)-1-pyrimidin-5-ylpropan-1-amine
CID 103030546
1-(3-methylimidazol-4-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103012064
1-(1-methylpyrazol-4-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103010531
1-(3,5-dimethylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103030528
1-(2-methylpyrazol-3-yl)pentan-3-amine
CID 64505334
5-(2-methylpyrazol-3-yl)pentan-2-amine
CID 103004310
4-(2-methylpyrazol-3-yl)-1-pyridin-3-ylbutan-2-amine
CID 103009787
3-(2-methylpyrazol-3-yl)-1-(3,4,5-trifluorophenyl)propan-1-amine
CID 103009601
3-(2-methylpyrazol-3-yl)-1-(4-methylsulfanylphenyl)propan-1-amine
CID 103030963
1-(3,4-dimethylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103031043
1-(4-bromo-2-methylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103030747
1-(2,5-dibromophenyl)-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103030513

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylpyrazol-3-yl)-1-pyrazin-2-ylpropan-1-amine?
The IUPAC name of 3-(2-methylpyrazol-3-yl)-1-pyrazin-2-ylpropan-1-amine (CID 103009015) is 3-(2-methylpyrazol-3-yl)-1-pyrazin-2-ylpropan-1-amine.
What is the SMILES notation for 3-(2-methylpyrazol-3-yl)-1-pyrazin-2-ylpropan-1-amine?
The canonical SMILES for 3-(2-methylpyrazol-3-yl)-1-pyrazin-2-ylpropan-1-amine is Cn1nccc1CCC(N)c1cnccn1.
What is the InChIKey of 3-(2-methylpyrazol-3-yl)-1-pyrazin-2-ylpropan-1-amine?
The InChIKey is WVCKWYUOGUKWMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-16-9(4-5-15-16)2-3-10(12)11-8-13-6-7-14-11/h4-8,10H,2-3,12H2,1H3.
What are the key properties of 3-(2-methylpyrazol-3-yl)-1-pyrazin-2-ylpropan-1-amine?
3-(2-methylpyrazol-3-yl)-1-pyrazin-2-ylpropan-1-amine has a molecular weight of 217.28 g/mol, XLogP of 0.84, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylpyrazol-3-yl)-1-pyrazin-2-ylpropan-1-amine is sourced from PubChem (CID 103009015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).