7-methyl-3-(2-methylbutyl)imidazo[4,5-b]pyridin-2-amine

C12H18N4 — CID 79293994

IUPAC7-methyl-3-(2-methylbutyl)imidazo[4,5-b]pyridin-2-amine
SMILESCCC(C)Cn1c(N)nc2c(C)ccnc21
InChIInChI=1S/C12H18N4/c1-4-8(2)7-16-11-10(15-12(16)13)9(3)5-6-14-11/h5-6,8H,4,7H2,1-3H3,(H2,13,15)
InChIKeyHSBQIKRZPCYMOM-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.37
Rot. Bonds3

About 7-methyl-3-(2-methylbutyl)imidazo[4,5-b]pyridin-2-amine

7-methyl-3-(2-methylbutyl)imidazo[4,5-b]pyridin-2-amine (PubChem CID 79293994) has the molecular formula C12H18N4 and a molecular weight of 218.30 g/mol. Its IUPAC name is 7-methyl-3-(2-methylbutyl)imidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name7-methyl-3-(2-methylbutyl)imidazo[4,5-b]pyridin-2-amine
PubChem CID79293994
Molecular FormulaC12H18N4
Molecular Weight218.30 g/mol
Exact Mass218.15
IUPAC Name7-methyl-3-(2-methylbutyl)imidazo[4,5-b]pyridin-2-amine
SMILESCCC(C)Cn1c(N)nc2c(C)ccnc21
InChIInChI=1S/C12H18N4/c1-4-8(2)7-16-11-10(15-12(16)13)9(3)5-6-14-11/h5-6,8H,4,7H2,1-3H3,(H2,13,15)
InChIKeyHSBQIKRZPCYMOM-UHFFFAOYSA-N
XLogP2.37
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 7-methyl-3-(2-methylbutyl)imidazo[4,5-b]pyridin-2-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-methyl-3-(2-methylbutyl)imidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 7-methyl-3-(2-methylbutyl)imidazo[4,5-b]pyridin-2-amine (CID 79293994) is 7-methyl-3-(2-methylbutyl)imidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 7-methyl-3-(2-methylbutyl)imidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 7-methyl-3-(2-methylbutyl)imidazo[4,5-b]pyridin-2-amine is CCC(C)Cn1c(N)nc2c(C)ccnc21.
What is the InChIKey of 7-methyl-3-(2-methylbutyl)imidazo[4,5-b]pyridin-2-amine?
The InChIKey is HSBQIKRZPCYMOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4/c1-4-8(2)7-16-11-10(15-12(16)13)9(3)5-6-14-11/h5-6,8H,4,7H2,1-3H3,(H2,13,15).
What are the key properties of 7-methyl-3-(2-methylbutyl)imidazo[4,5-b]pyridin-2-amine?
7-methyl-3-(2-methylbutyl)imidazo[4,5-b]pyridin-2-amine has a molecular weight of 218.30 g/mol, XLogP of 2.37, 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-methylbutyl)imidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 79293994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).