[2-(3,4-dimethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine

C16H16FN3O2 — CID 82060633

IUPAC[2-(3,4-dimethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine
SMILESCOc1ccc(-c2nc3ccc(F)cn3c2CN)cc1OC
InChIInChI=1S/C16H16FN3O2/c1-21-13-5-3-10(7-14(13)22-2)16-12(8-18)20-9-11(17)4-6-15(20)19-16/h3-7,9H,8,18H2,1-2H3
InChIKeyRELAWMBBNYILGO-UHFFFAOYSA-N
MW301.32 g/mol
LogP2.62
Rot. Bonds4

About [2-(3,4-dimethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine

[2-(3,4-dimethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine (PubChem CID 82060633) has the molecular formula C16H16FN3O2 and a molecular weight of 301.32 g/mol. Its IUPAC name is [2-(3,4-dimethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine.

Molecular Properties

Compound Name[2-(3,4-dimethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine
PubChem CID82060633
Molecular FormulaC16H16FN3O2
Molecular Weight301.32 g/mol
Exact Mass301.12
IUPAC Name[2-(3,4-dimethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine
SMILESCOc1ccc(-c2nc3ccc(F)cn3c2CN)cc1OC
InChIInChI=1S/C16H16FN3O2/c1-21-13-5-3-10(7-14(13)22-2)16-12(8-18)20-9-11(17)4-6-15(20)19-16/h3-7,9H,8,18H2,1-2H3
InChIKeyRELAWMBBNYILGO-UHFFFAOYSA-N
XLogP2.62
TPSA61.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.32
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[6-chloro-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 39199396
[2-(4-tert-butylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine
CID 82060626
6-chloro-3-(chloromethyl)-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridine
CID 39133106
2-[6-fluoro-2-(4-fluoro-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanamine
CID 82530532
2-[2-(3,4-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 39127619
[2-(2-ethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine
CID 82060637
[6-(3,4-dimethoxyphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 82367621
6-fluoro-2-(4-methoxy-3-methylphenyl)-3-nitrosoimidazo[1,2-a]pyridine
CID 82356749
2-[6-fluoro-2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]acetic acid
CID 82060605
3-(chloromethyl)-6-fluoro-2-(4-fluorophenyl)imidazo[1,2-a]pyridine;hydrochloride
CID 67030270
2-(3,4-dimethoxyphenyl)-3,7-dimethylimidazo[1,2-a]pyridin-6-amine
CID 82060074
[2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine
CID 95474904

Frequently Asked Questions

What is the IUPAC name of [2-(3,4-dimethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine?
The IUPAC name of [2-(3,4-dimethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine (CID 82060633) is [2-(3,4-dimethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine.
What is the SMILES notation for [2-(3,4-dimethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine?
The canonical SMILES for [2-(3,4-dimethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine is COc1ccc(-c2nc3ccc(F)cn3c2CN)cc1OC.
What is the InChIKey of [2-(3,4-dimethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine?
The InChIKey is RELAWMBBNYILGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FN3O2/c1-21-13-5-3-10(7-14(13)22-2)16-12(8-18)20-9-11(17)4-6-15(20)19-16/h3-7,9H,8,18H2,1-2H3.
What are the key properties of [2-(3,4-dimethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine?
[2-(3,4-dimethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine has a molecular weight of 301.32 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,4-dimethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine is sourced from PubChem (CID 82060633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).