7-methyl-3-[2-(4-methylphenyl)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine

C16H18N4 — CID 82061309

IUPAC7-methyl-3-[2-(4-methylphenyl)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine
SMILESCc1ccc(CCc2nnc3cc(C)c(N)cn23)cc1
InChIInChI=1S/C16H18N4/c1-11-3-5-13(6-4-11)7-8-15-18-19-16-9-12(2)14(17)10-20(15)16/h3-6,9-10H,7-8,17H2,1-2H3
InChIKeyNASPADUAZHHWBZ-UHFFFAOYSA-N
MW266.35 g/mol
LogP2.71
Rot. Bonds3

About 7-methyl-3-[2-(4-methylphenyl)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine

7-methyl-3-[2-(4-methylphenyl)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine (PubChem CID 82061309) has the molecular formula C16H18N4 and a molecular weight of 266.35 g/mol. Its IUPAC name is 7-methyl-3-[2-(4-methylphenyl)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine.

Molecular Properties

Compound Name7-methyl-3-[2-(4-methylphenyl)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine
PubChem CID82061309
Molecular FormulaC16H18N4
Molecular Weight266.35 g/mol
Exact Mass266.15
IUPAC Name7-methyl-3-[2-(4-methylphenyl)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine
SMILESCc1ccc(CCc2nnc3cc(C)c(N)cn23)cc1
InChIInChI=1S/C16H18N4/c1-11-3-5-13(6-4-11)7-8-15-18-19-16-9-12(2)14(17)10-20(15)16/h3-6,9-10H,7-8,17H2,1-2H3
InChIKeyNASPADUAZHHWBZ-UHFFFAOYSA-N
XLogP2.71
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.35
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 7-methyl-3-[2-(4-methylphenyl)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[2-(6-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]aniline
CID 82058656
3-(4-bromophenyl)-7-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-amine
CID 82061271
2-(6-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanol
CID 105436826
3-(bromomethyl)-5-[2-(4-methylphenyl)ethyl]-4-propan-2-yl-1,2,4-triazole
CID 113302336
[4-methyl-5-[2-(4-methylphenyl)ethyl]-1,2,4-triazol-3-yl]hydrazine
CID 35754974
4-[2-[4-[2-(4-amino-3-methylphenyl)ethyl]phenyl]ethyl]-2-methylaniline
CID 68660073
3-[(4-bromophenyl)methyl]-6-methyl-[1,2,4]triazolo[4,3-a]pyridine
CID 117139685
2-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanamine
CID 79002399
7-chloro-3-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridine
CID 117144572
4-[2-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)ethyl]aniline
CID 113290443
2-[2-(7-methyl-[1,2,4]triazolo[4,3-c]pyrimidin-3-yl)ethyl]aniline
CID 107273695
2-fluoro-5-[2-(4-methylphenyl)ethyl]aniline
CID 58021964

Frequently Asked Questions

What is the IUPAC name of 7-methyl-3-[2-(4-methylphenyl)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine?
The IUPAC name of 7-methyl-3-[2-(4-methylphenyl)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine (CID 82061309) is 7-methyl-3-[2-(4-methylphenyl)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine.
What is the SMILES notation for 7-methyl-3-[2-(4-methylphenyl)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine?
The canonical SMILES for 7-methyl-3-[2-(4-methylphenyl)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine is Cc1ccc(CCc2nnc3cc(C)c(N)cn23)cc1.
What is the InChIKey of 7-methyl-3-[2-(4-methylphenyl)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine?
The InChIKey is NASPADUAZHHWBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4/c1-11-3-5-13(6-4-11)7-8-15-18-19-16-9-12(2)14(17)10-20(15)16/h3-6,9-10H,7-8,17H2,1-2H3.
What are the key properties of 7-methyl-3-[2-(4-methylphenyl)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine?
7-methyl-3-[2-(4-methylphenyl)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine has a molecular weight of 266.35 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3-[2-(4-methylphenyl)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine is sourced from PubChem (CID 82061309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).