2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-N-methylethanamine

C11H16N4O — CID 79815427

IUPAC2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-N-methylethanamine
SMILESCCOc1ccc2[nH]c(CCNC)nc2n1
InChIInChI=1S/C11H16N4O/c1-3-16-10-5-4-8-11(15-10)14-9(13-8)6-7-12-2/h4-5,12H,3,6-7H2,1-2H3,(H,13,14,15)
InChIKeySIRUNOFNGJRNPN-UHFFFAOYSA-N
MW220.28 g/mol
LogP1.12
Rot. Bonds5

About 2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-N-methylethanamine

2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-N-methylethanamine (PubChem CID 79815427) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-N-methylethanamine.

Molecular Properties

Compound Name2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-N-methylethanamine
PubChem CID79815427
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-N-methylethanamine
SMILESCCOc1ccc2[nH]c(CCNC)nc2n1
InChIInChI=1S/C11H16N4O/c1-3-16-10-5-4-8-11(15-10)14-9(13-8)6-7-12-2/h4-5,12H,3,6-7H2,1-2H3,(H,13,14,15)
InChIKeySIRUNOFNGJRNPN-UHFFFAOYSA-N
XLogP1.12
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-N-methylethanamine?
The IUPAC name of 2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-N-methylethanamine (CID 79815427) is 2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-N-methylethanamine.
What is the SMILES notation for 2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-N-methylethanamine?
The canonical SMILES for 2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-N-methylethanamine is CCOc1ccc2[nH]c(CCNC)nc2n1.
What is the InChIKey of 2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-N-methylethanamine?
The InChIKey is SIRUNOFNGJRNPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-3-16-10-5-4-8-11(15-10)14-9(13-8)6-7-12-2/h4-5,12H,3,6-7H2,1-2H3,(H,13,14,15).
What are the key properties of 2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-N-methylethanamine?
2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-N-methylethanamine has a molecular weight of 220.28 g/mol, XLogP of 1.12, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-N-methylethanamine is sourced from PubChem (CID 79815427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).