1-[2-(3-methoxyphenoxy)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine

C16H17N3O2 — CID 43478665

IUPAC1-[2-(3-methoxyphenoxy)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine
SMILESCNCc1c(Oc2cccc(OC)c2)nc2ccccn12
InChIInChI=1S/C16H17N3O2/c1-17-11-14-16(18-15-8-3-4-9-19(14)15)21-13-7-5-6-12(10-13)20-2/h3-10,17H,11H2,1-2H3
InChIKeyYRLXSXFNWXIKKS-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.85
Rot. Bonds5

About 1-[2-(3-methoxyphenoxy)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine

1-[2-(3-methoxyphenoxy)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine (PubChem CID 43478665) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is 1-[2-(3-methoxyphenoxy)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(3-methoxyphenoxy)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine
PubChem CID43478665
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name1-[2-(3-methoxyphenoxy)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine
SMILESCNCc1c(Oc2cccc(OC)c2)nc2ccccn12
InChIInChI=1S/C16H17N3O2/c1-17-11-14-16(18-15-8-3-4-9-19(14)15)21-13-7-5-6-12(10-13)20-2/h3-10,17H,11H2,1-2H3
InChIKeyYRLXSXFNWXIKKS-UHFFFAOYSA-N
XLogP2.85
TPSA47.79 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-methoxyphenoxy)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[2-(3-methoxyphenoxy)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine (CID 43478665) is 1-[2-(3-methoxyphenoxy)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(3-methoxyphenoxy)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(3-methoxyphenoxy)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine is CNCc1c(Oc2cccc(OC)c2)nc2ccccn12.
What is the InChIKey of 1-[2-(3-methoxyphenoxy)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine?
The InChIKey is YRLXSXFNWXIKKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-17-11-14-16(18-15-8-3-4-9-19(14)15)21-13-7-5-6-12(10-13)20-2/h3-10,17H,11H2,1-2H3.
What are the key properties of 1-[2-(3-methoxyphenoxy)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine?
1-[2-(3-methoxyphenoxy)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine has a molecular weight of 283.33 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-methoxyphenoxy)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine is sourced from PubChem (CID 43478665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).