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

C13H20N4 — CID 79288525

IUPAC7-methyl-3-(3-methylpentan-2-yl)imidazo[4,5-b]pyridin-2-amine
SMILESCCC(C)C(C)n1c(N)nc2c(C)ccnc21
InChIInChI=1S/C13H20N4/c1-5-8(2)10(4)17-12-11(16-13(17)14)9(3)6-7-15-12/h6-8,10H,5H2,1-4H3,(H2,14,16)
InChIKeyGNSBRQITAOOGQL-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.93
Rot. Bonds3

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

7-methyl-3-(3-methylpentan-2-yl)imidazo[4,5-b]pyridin-2-amine (PubChem CID 79288525) has the molecular formula C13H20N4 and a molecular weight of 232.33 g/mol. Its IUPAC name is 7-methyl-3-(3-methylpentan-2-yl)imidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name7-methyl-3-(3-methylpentan-2-yl)imidazo[4,5-b]pyridin-2-amine
PubChem CID79288525
Molecular FormulaC13H20N4
Molecular Weight232.33 g/mol
Exact Mass232.17
IUPAC Name7-methyl-3-(3-methylpentan-2-yl)imidazo[4,5-b]pyridin-2-amine
SMILESCCC(C)C(C)n1c(N)nc2c(C)ccnc21
InChIInChI=1S/C13H20N4/c1-5-8(2)10(4)17-12-11(16-13(17)14)9(3)6-7-15-12/h6-8,10H,5H2,1-4H3,(H2,14,16)
InChIKeyGNSBRQITAOOGQL-UHFFFAOYSA-N
XLogP2.93
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-3-(3-methylpentan-2-yl)imidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 7-methyl-3-(3-methylpentan-2-yl)imidazo[4,5-b]pyridin-2-amine (CID 79288525) is 7-methyl-3-(3-methylpentan-2-yl)imidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 7-methyl-3-(3-methylpentan-2-yl)imidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 7-methyl-3-(3-methylpentan-2-yl)imidazo[4,5-b]pyridin-2-amine is CCC(C)C(C)n1c(N)nc2c(C)ccnc21.
What is the InChIKey of 7-methyl-3-(3-methylpentan-2-yl)imidazo[4,5-b]pyridin-2-amine?
The InChIKey is GNSBRQITAOOGQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4/c1-5-8(2)10(4)17-12-11(16-13(17)14)9(3)6-7-15-12/h6-8,10H,5H2,1-4H3,(H2,14,16).
What are the key properties of 7-methyl-3-(3-methylpentan-2-yl)imidazo[4,5-b]pyridin-2-amine?
7-methyl-3-(3-methylpentan-2-yl)imidazo[4,5-b]pyridin-2-amine has a molecular weight of 232.33 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3-(3-methylpentan-2-yl)imidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 79288525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).