4-[2-(1-methyltriazol-4-yl)ethyl]pyridin-2-amine

C10H13N5 — CID 107054471

IUPAC4-[2-(1-methyltriazol-4-yl)ethyl]pyridin-2-amine
SMILESCn1cc(CCc2ccnc(N)c2)nn1
InChIInChI=1S/C10H13N5/c1-15-7-9(13-14-15)3-2-8-4-5-12-10(11)6-8/h4-7H,2-3H2,1H3,(H2,11,12)
InChIKeyKZFJGNWRQANWST-UHFFFAOYSA-N
MW203.25 g/mol
LogP0.58
Rot. Bonds3

About 4-[2-(1-methyltriazol-4-yl)ethyl]pyridin-2-amine

4-[2-(1-methyltriazol-4-yl)ethyl]pyridin-2-amine (PubChem CID 107054471) has the molecular formula C10H13N5 and a molecular weight of 203.25 g/mol. Its IUPAC name is 4-[2-(1-methyltriazol-4-yl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name4-[2-(1-methyltriazol-4-yl)ethyl]pyridin-2-amine
PubChem CID107054471
Molecular FormulaC10H13N5
Molecular Weight203.25 g/mol
Exact Mass203.12
IUPAC Name4-[2-(1-methyltriazol-4-yl)ethyl]pyridin-2-amine
SMILESCn1cc(CCc2ccnc(N)c2)nn1
InChIInChI=1S/C10H13N5/c1-15-7-9(13-14-15)3-2-8-4-5-12-10(11)6-8/h4-7H,2-3H2,1H3,(H2,11,12)
InChIKeyKZFJGNWRQANWST-UHFFFAOYSA-N
XLogP0.58
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 ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(1-methyltriazol-4-yl)ethyl]pyridin-2-amine?
The IUPAC name of 4-[2-(1-methyltriazol-4-yl)ethyl]pyridin-2-amine (CID 107054471) is 4-[2-(1-methyltriazol-4-yl)ethyl]pyridin-2-amine.
What is the SMILES notation for 4-[2-(1-methyltriazol-4-yl)ethyl]pyridin-2-amine?
The canonical SMILES for 4-[2-(1-methyltriazol-4-yl)ethyl]pyridin-2-amine is Cn1cc(CCc2ccnc(N)c2)nn1.
What is the InChIKey of 4-[2-(1-methyltriazol-4-yl)ethyl]pyridin-2-amine?
The InChIKey is KZFJGNWRQANWST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5/c1-15-7-9(13-14-15)3-2-8-4-5-12-10(11)6-8/h4-7H,2-3H2,1H3,(H2,11,12).
What are the key properties of 4-[2-(1-methyltriazol-4-yl)ethyl]pyridin-2-amine?
4-[2-(1-methyltriazol-4-yl)ethyl]pyridin-2-amine has a molecular weight of 203.25 g/mol, XLogP of 0.58, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(1-methyltriazol-4-yl)ethyl]pyridin-2-amine is sourced from PubChem (CID 107054471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).