3-tert-butyl-7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-amine

C11H16N4 — CID 82061173

IUPAC3-tert-butyl-7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-amine
SMILESCc1ccn2c(C(C)(C)C)nnc2c1N
InChIInChI=1S/C11H16N4/c1-7-5-6-15-9(8(7)12)13-14-10(15)11(2,3)4/h5-6H,12H2,1-4H3
InChIKeyWMTCMEGRLUKBSF-UHFFFAOYSA-N
MW204.28 g/mol
LogP1.92
Rot. Bonds

About 3-tert-butyl-7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-amine

3-tert-butyl-7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-amine (PubChem CID 82061173) has the molecular formula C11H16N4 and a molecular weight of 204.28 g/mol. Its IUPAC name is 3-tert-butyl-7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-amine.

Molecular Properties

Compound Name3-tert-butyl-7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-amine
PubChem CID82061173
Molecular FormulaC11H16N4
Molecular Weight204.28 g/mol
Exact Mass204.14
IUPAC Name3-tert-butyl-7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-amine
SMILESCc1ccn2c(C(C)(C)C)nnc2c1N
InChIInChI=1S/C11H16N4/c1-7-5-6-15-9(8(7)12)13-14-10(15)11(2,3)4/h5-6H,12H2,1-4H3
InChIKeyWMTCMEGRLUKBSF-UHFFFAOYSA-N
XLogP1.92
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.28
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-tert-butyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)ethanamine
CID 83866552
3-tert-butyl-8-chloro-[1,2,4]triazolo[4,3-a]pyridine
CID 15754777
3-tert-butyl-8-methoxy-[1,2,4]triazolo[4,3-a]pyridine
CID 117145572
2-tert-butyl-7-methylimidazo[1,2-a]pyridin-8-amine
CID 82059965
3-tert-butyl-[1,2,4]triazolo[4,3-a]pyridine-8-carboxylic acid
CID 58074730
3-[(2,5-dimethylphenoxy)methyl]-7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-amine
CID 82061219
2-(3-tert-butyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)acetic acid
CID 83866558
3-tert-butyl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylic acid
CID 83641424
3-tert-butyl-7-(2,3,3-trimethylbutan-2-yl)-[1,2,4]triazolo[4,3-a]pyrazin-7-ium
CID 58465369
2-tert-butyl-8-methylimidazo[1,5-a]pyrimidin-6-amine
CID 139442601
8-methylpyrrolo[1,2-a][1,3,5]triazin-4-amine
CID 163432365
2-(3-tert-butyl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)acetaldehyde
CID 83887597

Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-amine?
The IUPAC name of 3-tert-butyl-7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-amine (CID 82061173) is 3-tert-butyl-7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-amine.
What is the SMILES notation for 3-tert-butyl-7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-amine?
The canonical SMILES for 3-tert-butyl-7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-amine is Cc1ccn2c(C(C)(C)C)nnc2c1N.
What is the InChIKey of 3-tert-butyl-7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-amine?
The InChIKey is WMTCMEGRLUKBSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4/c1-7-5-6-15-9(8(7)12)13-14-10(15)11(2,3)4/h5-6H,12H2,1-4H3.
What are the key properties of 3-tert-butyl-7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-amine?
3-tert-butyl-7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-amine has a molecular weight of 204.28 g/mol, XLogP of 1.92, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-amine is sourced from PubChem (CID 82061173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).