1-[(2-methylcyclopropyl)methyl]-5-(2-methylpyrazol-3-yl)triazol-4-amine

C11H16N6 — CID 165485081

IUPAC1-[(2-methylcyclopropyl)methyl]-5-(2-methylpyrazol-3-yl)triazol-4-amine
SMILESCC1CC1Cn1nnc(N)c1-c1ccnn1C
InChIInChI=1S/C11H16N6/c1-7-5-8(7)6-17-10(11(12)14-15-17)9-3-4-13-16(9)2/h3-4,7-8H,5-6,12H2,1-2H3
InChIKeyTWOZLENSYLLDNW-UHFFFAOYSA-N
MW232.29 g/mol
LogP0.92
Rot. Bonds3

About 1-[(2-methylcyclopropyl)methyl]-5-(2-methylpyrazol-3-yl)triazol-4-amine

1-[(2-methylcyclopropyl)methyl]-5-(2-methylpyrazol-3-yl)triazol-4-amine (PubChem CID 165485081) has the molecular formula C11H16N6 and a molecular weight of 232.29 g/mol. Its IUPAC name is 1-[(2-methylcyclopropyl)methyl]-5-(2-methylpyrazol-3-yl)triazol-4-amine.

Molecular Properties

Compound Name1-[(2-methylcyclopropyl)methyl]-5-(2-methylpyrazol-3-yl)triazol-4-amine
PubChem CID165485081
Molecular FormulaC11H16N6
Molecular Weight232.29 g/mol
Exact Mass232.14
IUPAC Name1-[(2-methylcyclopropyl)methyl]-5-(2-methylpyrazol-3-yl)triazol-4-amine
SMILESCC1CC1Cn1nnc(N)c1-c1ccnn1C
InChIInChI=1S/C11H16N6/c1-7-5-8(7)6-17-10(11(12)14-15-17)9-3-4-13-16(9)2/h3-4,7-8H,5-6,12H2,1-2H3
InChIKeyTWOZLENSYLLDNW-UHFFFAOYSA-N
XLogP0.92
TPSA74.55 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-ethyl-5-(2-methylpyrazol-3-yl)triazol-4-amine
CID 165474795
5-(2-methylpyrazol-3-yl)-1-(2-propan-2-ylsulfanylethyl)triazol-4-amine
CID 165485126
5-(2-methylpyrazol-3-yl)-1-(1,2-oxazol-3-ylmethyl)triazol-4-amine
CID 165474811
[1-(2-ethoxyethyl)-5-(2-methylpyrazol-3-yl)triazol-4-yl]methanamine
CID 165474730
5-ethyl-1-[2-(2-methylpyrazol-3-yl)ethyl]triazol-4-amine
CID 103019252
5-bromo-6-cyclopropyl-2-(2-methylpyrazol-3-yl)pyrimidin-4-amine
CID 114554378
4-(2-methylpyrazol-3-yl)benzene-1,2-diamine
CID 91618945
5-bromo-6-cyclopentyl-2-(2-methylpyrazol-3-yl)pyrimidin-4-amine
CID 114554404
(2-methylcyclopropyl)-(2-methylpyrazol-3-yl)methanamine
CID 65422135
2-methyl-1-[5-(2-methylpyrazol-3-yl)-1H-1,2,4-triazol-3-yl]piperidin-3-amine
CID 102798801
3-(2-methylpyrazol-3-yl)-1-pentan-3-ylpyrazol-4-amine
CID 106758620
[1-(1-methoxypropan-2-yl)-5-(2-methylpyrazol-3-yl)triazol-4-yl]methanamine
CID 165474789

Frequently Asked Questions

What is the IUPAC name of 1-[(2-methylcyclopropyl)methyl]-5-(2-methylpyrazol-3-yl)triazol-4-amine?
The IUPAC name of 1-[(2-methylcyclopropyl)methyl]-5-(2-methylpyrazol-3-yl)triazol-4-amine (CID 165485081) is 1-[(2-methylcyclopropyl)methyl]-5-(2-methylpyrazol-3-yl)triazol-4-amine.
What is the SMILES notation for 1-[(2-methylcyclopropyl)methyl]-5-(2-methylpyrazol-3-yl)triazol-4-amine?
The canonical SMILES for 1-[(2-methylcyclopropyl)methyl]-5-(2-methylpyrazol-3-yl)triazol-4-amine is CC1CC1Cn1nnc(N)c1-c1ccnn1C.
What is the InChIKey of 1-[(2-methylcyclopropyl)methyl]-5-(2-methylpyrazol-3-yl)triazol-4-amine?
The InChIKey is TWOZLENSYLLDNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N6/c1-7-5-8(7)6-17-10(11(12)14-15-17)9-3-4-13-16(9)2/h3-4,7-8H,5-6,12H2,1-2H3.
What are the key properties of 1-[(2-methylcyclopropyl)methyl]-5-(2-methylpyrazol-3-yl)triazol-4-amine?
1-[(2-methylcyclopropyl)methyl]-5-(2-methylpyrazol-3-yl)triazol-4-amine has a molecular weight of 232.29 g/mol, XLogP of 0.92, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methylcyclopropyl)methyl]-5-(2-methylpyrazol-3-yl)triazol-4-amine is sourced from PubChem (CID 165485081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).