7-methyl-N-(1-piperidin-3-ylethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine

C14H21N5 — CID 62045875

IUPAC7-methyl-N-(1-piperidin-3-ylethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine
SMILESCc1cc(NC(C)C2CCCNC2)n2ncnc2c1
InChIInChI=1S/C14H21N5/c1-10-6-13-16-9-17-19(13)14(7-10)18-11(2)12-4-3-5-15-8-12/h6-7,9,11-12,15,18H,3-5,8H2,1-2H3
InChIKeyLANVVCMYMSHKBQ-UHFFFAOYSA-N
MW259.36 g/mol
LogP1.84
Rot. Bonds3

About 7-methyl-N-(1-piperidin-3-ylethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine

7-methyl-N-(1-piperidin-3-ylethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine (PubChem CID 62045875) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is 7-methyl-N-(1-piperidin-3-ylethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine.

Molecular Properties

Compound Name7-methyl-N-(1-piperidin-3-ylethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine
PubChem CID62045875
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC Name7-methyl-N-(1-piperidin-3-ylethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine
SMILESCc1cc(NC(C)C2CCCNC2)n2ncnc2c1
InChIInChI=1S/C14H21N5/c1-10-6-13-16-9-17-19(13)14(7-10)18-11(2)12-4-3-5-15-8-12/h6-7,9,11-12,15,18H,3-5,8H2,1-2H3
InChIKeyLANVVCMYMSHKBQ-UHFFFAOYSA-N
XLogP1.84
TPSA54.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-N-(1-piperidin-3-ylethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
The IUPAC name of 7-methyl-N-(1-piperidin-3-ylethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine (CID 62045875) is 7-methyl-N-(1-piperidin-3-ylethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine.
What is the SMILES notation for 7-methyl-N-(1-piperidin-3-ylethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
The canonical SMILES for 7-methyl-N-(1-piperidin-3-ylethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine is Cc1cc(NC(C)C2CCCNC2)n2ncnc2c1.
What is the InChIKey of 7-methyl-N-(1-piperidin-3-ylethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
The InChIKey is LANVVCMYMSHKBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-10-6-13-16-9-17-19(13)14(7-10)18-11(2)12-4-3-5-15-8-12/h6-7,9,11-12,15,18H,3-5,8H2,1-2H3.
What are the key properties of 7-methyl-N-(1-piperidin-3-ylethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
7-methyl-N-(1-piperidin-3-ylethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine has a molecular weight of 259.36 g/mol, XLogP of 1.84, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-N-(1-piperidin-3-ylethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine is sourced from PubChem (CID 62045875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).