1-[1-[2-(2-methylpyrazol-3-yl)ethyl]triazol-4-yl]ethanamine

C10H16N6 — CID 103014135

IUPAC1-[1-[2-(2-methylpyrazol-3-yl)ethyl]triazol-4-yl]ethanamine
SMILESCC(N)c1cn(CCc2ccnn2C)nn1
InChIInChI=1S/C10H16N6/c1-8(11)10-7-16(14-13-10)6-4-9-3-5-12-15(9)2/h3,5,7-8H,4,6,11H2,1-2H3
InChIKeyJGGZPZXGGJNCNF-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.27
Rot. Bonds4

About 1-[1-[2-(2-methylpyrazol-3-yl)ethyl]triazol-4-yl]ethanamine

1-[1-[2-(2-methylpyrazol-3-yl)ethyl]triazol-4-yl]ethanamine (PubChem CID 103014135) has the molecular formula C10H16N6 and a molecular weight of 220.28 g/mol. Its IUPAC name is 1-[1-[2-(2-methylpyrazol-3-yl)ethyl]triazol-4-yl]ethanamine.

Molecular Properties

Compound Name1-[1-[2-(2-methylpyrazol-3-yl)ethyl]triazol-4-yl]ethanamine
PubChem CID103014135
Molecular FormulaC10H16N6
Molecular Weight220.28 g/mol
Exact Mass220.14
IUPAC Name1-[1-[2-(2-methylpyrazol-3-yl)ethyl]triazol-4-yl]ethanamine
SMILESCC(N)c1cn(CCc2ccnn2C)nn1
InChIInChI=1S/C10H16N6/c1-8(11)10-7-16(14-13-10)6-4-9-3-5-12-15(9)2/h3,5,7-8H,4,6,11H2,1-2H3
InChIKeyJGGZPZXGGJNCNF-UHFFFAOYSA-N
XLogP0.27
TPSA74.55 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-(diethoxymethyl)-1-[2-(2-methylpyrazol-3-yl)ethyl]triazole
CID 103018721
1-[1-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-4-yl]ethanamine
CID 103014913
3-[4-(1-aminoethyl)triazol-1-yl]propan-1-amine
CID 114419828
5-(2-methylpyrazol-3-yl)pentan-2-amine
CID 103004310
4-[4-(1-aminoethyl)triazol-1-yl]butan-2-ol
CID 114419575
1-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]triazol-4-yl]ethanamine
CID 114419969
1-[1-(2-methoxyethyl)triazol-4-yl]ethanamine
CID 114420137
1-[1-(3-ethoxypropyl)triazol-4-yl]ethanamine
CID 114420179
4-[[4-(1-aminoethyl)triazol-1-yl]methyl]phenol
CID 114419757
1-[1-(2-methylsulfonylethyl)triazol-4-yl]ethanamine
CID 114419540
1-[1-[(4-chlorophenyl)methyl]triazol-4-yl]ethanamine
CID 114419662
1-[1-[(4-methylphenyl)methyl]triazol-4-yl]ethanamine
CID 114419617

Frequently Asked Questions

What is the IUPAC name of 1-[1-[2-(2-methylpyrazol-3-yl)ethyl]triazol-4-yl]ethanamine?
The IUPAC name of 1-[1-[2-(2-methylpyrazol-3-yl)ethyl]triazol-4-yl]ethanamine (CID 103014135) is 1-[1-[2-(2-methylpyrazol-3-yl)ethyl]triazol-4-yl]ethanamine.
What is the SMILES notation for 1-[1-[2-(2-methylpyrazol-3-yl)ethyl]triazol-4-yl]ethanamine?
The canonical SMILES for 1-[1-[2-(2-methylpyrazol-3-yl)ethyl]triazol-4-yl]ethanamine is CC(N)c1cn(CCc2ccnn2C)nn1.
What is the InChIKey of 1-[1-[2-(2-methylpyrazol-3-yl)ethyl]triazol-4-yl]ethanamine?
The InChIKey is JGGZPZXGGJNCNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N6/c1-8(11)10-7-16(14-13-10)6-4-9-3-5-12-15(9)2/h3,5,7-8H,4,6,11H2,1-2H3.
What are the key properties of 1-[1-[2-(2-methylpyrazol-3-yl)ethyl]triazol-4-yl]ethanamine?
1-[1-[2-(2-methylpyrazol-3-yl)ethyl]triazol-4-yl]ethanamine has a molecular weight of 220.28 g/mol, XLogP of 0.27, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[2-(2-methylpyrazol-3-yl)ethyl]triazol-4-yl]ethanamine is sourced from PubChem (CID 103014135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).