6-bromo-2-[3-(methoxymethyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-amine

C16H16BrN3O — CID 79736807

IUPAC6-bromo-2-[3-(methoxymethyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-amine
SMILESCOCc1cccc(-c2nc3cc(C)c(Br)cn3c2N)c1
InChIInChI=1S/C16H16BrN3O/c1-10-6-14-19-15(16(18)20(14)8-13(10)17)12-5-3-4-11(7-12)9-21-2/h3-8H,9,18H2,1-2H3
InChIKeyKARIAWWAKNZBON-UHFFFAOYSA-N
MW346.23 g/mol
LogP3.80
Rot. Bonds3

About 6-bromo-2-[3-(methoxymethyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-amine

6-bromo-2-[3-(methoxymethyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-amine (PubChem CID 79736807) has the molecular formula C16H16BrN3O and a molecular weight of 346.23 g/mol. Its IUPAC name is 6-bromo-2-[3-(methoxymethyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name6-bromo-2-[3-(methoxymethyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-amine
PubChem CID79736807
Molecular FormulaC16H16BrN3O
Molecular Weight346.23 g/mol
Exact Mass345.05
IUPAC Name6-bromo-2-[3-(methoxymethyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-amine
SMILESCOCc1cccc(-c2nc3cc(C)c(Br)cn3c2N)c1
InChIInChI=1S/C16H16BrN3O/c1-10-6-14-19-15(16(18)20(14)8-13(10)17)12-5-3-4-11(7-12)9-21-2/h3-8H,9,18H2,1-2H3
InChIKeyKARIAWWAKNZBON-UHFFFAOYSA-N
XLogP3.80
TPSA52.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.23
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-bromo-2-(3-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine
CID 79736825
3-(3-amino-6-bromo-7-methylimidazo[1,2-a]pyridin-2-yl)benzonitrile
CID 79730248
6-bromo-2-(3-cyclopropylphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine
CID 79970825
6-bromo-2-(2,6-difluorophenyl)-7-methylimidazo[1,2-a]pyridin-3-amine
CID 79728886
6-bromo-2-(4-bromo-3-fluorophenyl)-7-methylimidazo[1,2-a]pyridin-3-amine
CID 81441755
6-bromo-2-(4-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine
CID 79736812
6-bromo-2-(4-cyclopropylphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine
CID 79970826
6-bromo-2-(1-methoxypropan-2-yl)-7-methylimidazo[1,2-a]pyridin-3-amine
CID 116503183
6-bromo-2-(furan-2-yl)-7-methylimidazo[1,2-a]pyridin-3-amine
CID 79729151
6-bromo-7-methyl-2-(5-methylfuran-2-yl)imidazo[1,2-a]pyridin-3-amine
CID 79729064
6-bromo-2-(3-methoxyphenyl)imidazo[1,2-a]pyridin-3-amine
CID 63617918
6-bromo-7-methyl-2-(5-nitrofuran-2-yl)imidazo[1,2-a]pyridin-3-amine
CID 79736809

Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-[3-(methoxymethyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 6-bromo-2-[3-(methoxymethyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-amine (CID 79736807) is 6-bromo-2-[3-(methoxymethyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 6-bromo-2-[3-(methoxymethyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 6-bromo-2-[3-(methoxymethyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-amine is COCc1cccc(-c2nc3cc(C)c(Br)cn3c2N)c1.
What is the InChIKey of 6-bromo-2-[3-(methoxymethyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is KARIAWWAKNZBON-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16BrN3O/c1-10-6-14-19-15(16(18)20(14)8-13(10)17)12-5-3-4-11(7-12)9-21-2/h3-8H,9,18H2,1-2H3.
What are the key properties of 6-bromo-2-[3-(methoxymethyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-amine?
6-bromo-2-[3-(methoxymethyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 346.23 g/mol, XLogP of 3.80, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-[3-(methoxymethyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 79736807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).