2-[2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]ethanamine

C15H16N4O — CID 65484218

IUPAC2-[2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]ethanamine
SMILESCOc1ccc2[nH]c(-c3ccccc3CCN)nc2n1
InChIInChI=1S/C15H16N4O/c1-20-13-7-6-12-15(18-13)19-14(17-12)11-5-3-2-4-10(11)8-9-16/h2-7H,8-9,16H2,1H3,(H,17,18,19)
InChIKeyWTJLTUPWTBDUTG-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.13
Rot. Bonds4

About 2-[2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]ethanamine

2-[2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]ethanamine (PubChem CID 65484218) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is 2-[2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]ethanamine.

Molecular Properties

Compound Name2-[2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]ethanamine
PubChem CID65484218
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC Name2-[2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]ethanamine
SMILESCOc1ccc2[nH]c(-c3ccccc3CCN)nc2n1
InChIInChI=1S/C15H16N4O/c1-20-13-7-6-12-15(18-13)19-14(17-12)11-5-3-2-4-10(11)8-9-16/h2-7H,8-9,16H2,1H3,(H,17,18,19)
InChIKeyWTJLTUPWTBDUTG-UHFFFAOYSA-N
XLogP2.13
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]ethanamine?
The IUPAC name of 2-[2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]ethanamine (CID 65484218) is 2-[2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]ethanamine.
What is the SMILES notation for 2-[2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]ethanamine?
The canonical SMILES for 2-[2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]ethanamine is COc1ccc2[nH]c(-c3ccccc3CCN)nc2n1.
What is the InChIKey of 2-[2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]ethanamine?
The InChIKey is WTJLTUPWTBDUTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-20-13-7-6-12-15(18-13)19-14(17-12)11-5-3-2-4-10(11)8-9-16/h2-7H,8-9,16H2,1H3,(H,17,18,19).
What are the key properties of 2-[2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]ethanamine?
2-[2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]ethanamine has a molecular weight of 268.32 g/mol, XLogP of 2.13, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]ethanamine is sourced from PubChem (CID 65484218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).