[5-methyl-1-(pyridin-2-ylmethyl)triazol-4-yl]methanamine

C10H13N5 — CID 82506565

IUPAC[5-methyl-1-(pyridin-2-ylmethyl)triazol-4-yl]methanamine
SMILESCc1c(CN)nnn1Cc1ccccn1
InChIInChI=1S/C10H13N5/c1-8-10(6-11)13-14-15(8)7-9-4-2-3-5-12-9/h2-5H,6-7,11H2,1H3
InChIKeyZZYINSZEOZWWKP-UHFFFAOYSA-N
MW203.25 g/mol
LogP0.49
Rot. Bonds3

About [5-methyl-1-(pyridin-2-ylmethyl)triazol-4-yl]methanamine

[5-methyl-1-(pyridin-2-ylmethyl)triazol-4-yl]methanamine (PubChem CID 82506565) has the molecular formula C10H13N5 and a molecular weight of 203.25 g/mol. Its IUPAC name is [5-methyl-1-(pyridin-2-ylmethyl)triazol-4-yl]methanamine.

Molecular Properties

Compound Name[5-methyl-1-(pyridin-2-ylmethyl)triazol-4-yl]methanamine
PubChem CID82506565
Molecular FormulaC10H13N5
Molecular Weight203.25 g/mol
Exact Mass203.12
IUPAC Name[5-methyl-1-(pyridin-2-ylmethyl)triazol-4-yl]methanamine
SMILESCc1c(CN)nnn1Cc1ccccn1
InChIInChI=1S/C10H13N5/c1-8-10(6-11)13-14-15(8)7-9-4-2-3-5-12-9/h2-5H,6-7,11H2,1H3
InChIKeyZZYINSZEOZWWKP-UHFFFAOYSA-N
XLogP0.49
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 5-(chloromethyl)-1-(pyridin-2-ylmethyl)triazole-4-carboxylate
CID 103109359
2-[(3,5-dimethylpyrazol-1-yl)methyl]pyridine
CID 12988154
ethyl 5-propan-2-yl-1-(pyridin-2-ylmethyl)triazole-4-carboxylate
CID 103105342
ethane;pyridin-2-ylmethanamine
CID 90791011
(5-methyl-1-phenyltriazol-4-yl)methanamine;dihydrochloride
CID 154878745
ethane;2-methylpyridine;pyridin-2-ylmethanamine
CID 158124738
[4-(pyridin-2-ylmethyl)-1,2,4-triazol-3-yl]methanamine
CID 82468720
3-(aminomethyl)-6-methyl-1-(pyridin-2-ylmethyl)pyridin-2-one
CID 107073142
[1-(pyridin-2-ylmethyl)-1,2,4-triazol-3-yl]methanamine
CID 62949782
3-[1-[(3-fluorophenyl)methyl]-5-methyltriazol-4-yl]propan-1-amine
CID 82211859
5-methyl-2-(pyridin-2-ylmethyl)pyrazole-3-carboxylic acid
CID 83534624
2-[[4-(methylsulfanylmethyl)triazol-1-yl]methyl]pyridine
CID 68514359

Frequently Asked Questions

What is the IUPAC name of [5-methyl-1-(pyridin-2-ylmethyl)triazol-4-yl]methanamine?
The IUPAC name of [5-methyl-1-(pyridin-2-ylmethyl)triazol-4-yl]methanamine (CID 82506565) is [5-methyl-1-(pyridin-2-ylmethyl)triazol-4-yl]methanamine.
What is the SMILES notation for [5-methyl-1-(pyridin-2-ylmethyl)triazol-4-yl]methanamine?
The canonical SMILES for [5-methyl-1-(pyridin-2-ylmethyl)triazol-4-yl]methanamine is Cc1c(CN)nnn1Cc1ccccn1.
What is the InChIKey of [5-methyl-1-(pyridin-2-ylmethyl)triazol-4-yl]methanamine?
The InChIKey is ZZYINSZEOZWWKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5/c1-8-10(6-11)13-14-15(8)7-9-4-2-3-5-12-9/h2-5H,6-7,11H2,1H3.
What are the key properties of [5-methyl-1-(pyridin-2-ylmethyl)triazol-4-yl]methanamine?
[5-methyl-1-(pyridin-2-ylmethyl)triazol-4-yl]methanamine has a molecular weight of 203.25 g/mol, XLogP of 0.49, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-methyl-1-(pyridin-2-ylmethyl)triazol-4-yl]methanamine is sourced from PubChem (CID 82506565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).