6-methyl-3-[1-(oxolan-2-yl)ethyl]imidazo[4,5-b]pyridin-2-amine

C13H18N4O — CID 79301180

IUPAC6-methyl-3-[1-(oxolan-2-yl)ethyl]imidazo[4,5-b]pyridin-2-amine
SMILESCc1cnc2c(c1)nc(N)n2C(C)C1CCCO1
InChIInChI=1S/C13H18N4O/c1-8-6-10-12(15-7-8)17(13(14)16-10)9(2)11-4-3-5-18-11/h6-7,9,11H,3-5H2,1-2H3,(H2,14,16)
InChIKeyJFOPPDJJHFKOIO-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.06
Rot. Bonds2

About 6-methyl-3-[1-(oxolan-2-yl)ethyl]imidazo[4,5-b]pyridin-2-amine

6-methyl-3-[1-(oxolan-2-yl)ethyl]imidazo[4,5-b]pyridin-2-amine (PubChem CID 79301180) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is 6-methyl-3-[1-(oxolan-2-yl)ethyl]imidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name6-methyl-3-[1-(oxolan-2-yl)ethyl]imidazo[4,5-b]pyridin-2-amine
PubChem CID79301180
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC Name6-methyl-3-[1-(oxolan-2-yl)ethyl]imidazo[4,5-b]pyridin-2-amine
SMILESCc1cnc2c(c1)nc(N)n2C(C)C1CCCO1
InChIInChI=1S/C13H18N4O/c1-8-6-10-12(15-7-8)17(13(14)16-10)9(2)11-4-3-5-18-11/h6-7,9,11H,3-5H2,1-2H3,(H2,14,16)
InChIKeyJFOPPDJJHFKOIO-UHFFFAOYSA-N
XLogP2.06
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[1-(oxolan-2-yl)ethyl]imidazo[4,5-c]pyridin-2-amine
CID 79296615
5-fluoro-1-[1-(oxolan-2-yl)ethyl]benzimidazol-2-amine
CID 43662119
6-bromo-2-(chloromethyl)-3-[1-(oxolan-2-yl)ethyl]imidazo[4,5-b]pyridine
CID 79301967
6-methyl-3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-amine
CID 79300760
3-(1-cyclopropylbutan-2-yl)-6-methylimidazo[4,5-b]pyridin-2-amine
CID 79301197
6-methyl-3-(6-methylheptan-2-yl)imidazo[4,5-b]pyridin-2-amine
CID 79300973
2-(1-chloroethyl)-5-methyl-1-[1-(oxolan-2-yl)ethyl]benzimidazole
CID 43667623
6-methyl-3-[1-(2-methylphenyl)ethyl]imidazo[4,5-b]pyridin-2-amine
CID 79301690
6-methyl-3-(3-methylcyclohexyl)imidazo[4,5-b]pyridin-2-amine
CID 79301684
3-[amino(oxolan-2-yl)methyl]-5-methylpyridin-2-amine
CID 65331488
3-[1-(dimethylamino)-4-methylpentan-2-yl]-6-methylimidazo[4,5-b]pyridin-2-amine
CID 79301405
2-tert-butyl-1-[1-(oxolan-2-yl)ethyl]benzimidazol-5-amine
CID 62507702

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-[1-(oxolan-2-yl)ethyl]imidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 6-methyl-3-[1-(oxolan-2-yl)ethyl]imidazo[4,5-b]pyridin-2-amine (CID 79301180) is 6-methyl-3-[1-(oxolan-2-yl)ethyl]imidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 6-methyl-3-[1-(oxolan-2-yl)ethyl]imidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 6-methyl-3-[1-(oxolan-2-yl)ethyl]imidazo[4,5-b]pyridin-2-amine is Cc1cnc2c(c1)nc(N)n2C(C)C1CCCO1.
What is the InChIKey of 6-methyl-3-[1-(oxolan-2-yl)ethyl]imidazo[4,5-b]pyridin-2-amine?
The InChIKey is JFOPPDJJHFKOIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O/c1-8-6-10-12(15-7-8)17(13(14)16-10)9(2)11-4-3-5-18-11/h6-7,9,11H,3-5H2,1-2H3,(H2,14,16).
What are the key properties of 6-methyl-3-[1-(oxolan-2-yl)ethyl]imidazo[4,5-b]pyridin-2-amine?
6-methyl-3-[1-(oxolan-2-yl)ethyl]imidazo[4,5-b]pyridin-2-amine has a molecular weight of 246.31 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-[1-(oxolan-2-yl)ethyl]imidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 79301180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).