2-[8-chloro-3-(4-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]ethanamine

C16H16ClN3O — CID 82529731

IUPAC2-[8-chloro-3-(4-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]ethanamine
SMILESCOc1ccc(-c2c(CCN)nc3c(Cl)cccn23)cc1
InChIInChI=1S/C16H16ClN3O/c1-21-12-6-4-11(5-7-12)15-14(8-9-18)19-16-13(17)3-2-10-20(15)16/h2-7,10H,8-9,18H2,1H3
InChIKeyQYEWFOYTVXLIKT-UHFFFAOYSA-N
MW301.78 g/mol
LogP3.16
Rot. Bonds4

About 2-[8-chloro-3-(4-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]ethanamine

2-[8-chloro-3-(4-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]ethanamine (PubChem CID 82529731) has the molecular formula C16H16ClN3O and a molecular weight of 301.78 g/mol. Its IUPAC name is 2-[8-chloro-3-(4-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]ethanamine.

Molecular Properties

Compound Name2-[8-chloro-3-(4-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]ethanamine
PubChem CID82529731
Molecular FormulaC16H16ClN3O
Molecular Weight301.78 g/mol
Exact Mass301.10
IUPAC Name2-[8-chloro-3-(4-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]ethanamine
SMILESCOc1ccc(-c2c(CCN)nc3c(Cl)cccn23)cc1
InChIInChI=1S/C16H16ClN3O/c1-21-12-6-4-11(5-7-12)15-14(8-9-18)19-16-13(17)3-2-10-20(15)16/h2-7,10H,8-9,18H2,1H3
InChIKeyQYEWFOYTVXLIKT-UHFFFAOYSA-N
XLogP3.16
TPSA52.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.78
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

8-chloro-3-(4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridine
CID 103095082
2-[6-chloro-3-(4-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]ethanamine
CID 28912634
2-(8-fluoro-3-phenylimidazo[1,2-a]pyridin-2-yl)ethanamine
CID 82529722
[8-chloro-2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanol
CID 82529532
2-[6-bromo-3-(4-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]ethanamine
CID 28912632
2-[3-(4-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-2-yl]ethanamine
CID 28912642
8-chloro-2-ethyl-3-[4-(3-ethylsulfonylphenoxy)phenyl]imidazo[1,2-a]pyridine
CID 58259601
3-(4-methoxyphenyl)-2,8-dimethylimidazo[1,2-a]pyridine
CID 115404302
2-(2-tert-butyl-8-chloroimidazo[1,2-a]pyridin-3-yl)ethanamine
CID 82529429
8-chloro-2-methyl-3-phenylimidazo[1,2-a]pyridine
CID 103095206
3-(4-methoxyphenyl)imidazo[1,2-a]pyridin-2-amine
CID 162644222
8-chloro-2-ethyl-3-[3-(3-ethylsulfanylphenoxy)phenyl]imidazo[1,2-a]pyridine
CID 143830717

Frequently Asked Questions

What is the IUPAC name of 2-[8-chloro-3-(4-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]ethanamine?
The IUPAC name of 2-[8-chloro-3-(4-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]ethanamine (CID 82529731) is 2-[8-chloro-3-(4-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]ethanamine.
What is the SMILES notation for 2-[8-chloro-3-(4-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]ethanamine?
The canonical SMILES for 2-[8-chloro-3-(4-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]ethanamine is COc1ccc(-c2c(CCN)nc3c(Cl)cccn23)cc1.
What is the InChIKey of 2-[8-chloro-3-(4-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]ethanamine?
The InChIKey is QYEWFOYTVXLIKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClN3O/c1-21-12-6-4-11(5-7-12)15-14(8-9-18)19-16-13(17)3-2-10-20(15)16/h2-7,10H,8-9,18H2,1H3.
What are the key properties of 2-[8-chloro-3-(4-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]ethanamine?
2-[8-chloro-3-(4-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]ethanamine has a molecular weight of 301.78 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[8-chloro-3-(4-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]ethanamine is sourced from PubChem (CID 82529731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).