6-chloro-2-(4-methoxy-2,6-dimethylphenyl)imidazo[1,2-a]pyridin-3-amine

C16H16ClN3O — CID 82530170

IUPAC6-chloro-2-(4-methoxy-2,6-dimethylphenyl)imidazo[1,2-a]pyridin-3-amine
SMILESCOc1cc(C)c(-c2nc3ccc(Cl)cn3c2N)c(C)c1
InChIInChI=1S/C16H16ClN3O/c1-9-6-12(21-3)7-10(2)14(9)15-16(18)20-8-11(17)4-5-13(20)19-15/h4-8H,18H2,1-3H3
InChIKeyOKAJYHFBNFUVID-UHFFFAOYSA-N
MW301.78 g/mol
LogP3.86
Rot. Bonds2

About 6-chloro-2-(4-methoxy-2,6-dimethylphenyl)imidazo[1,2-a]pyridin-3-amine

6-chloro-2-(4-methoxy-2,6-dimethylphenyl)imidazo[1,2-a]pyridin-3-amine (PubChem CID 82530170) has the molecular formula C16H16ClN3O and a molecular weight of 301.78 g/mol. Its IUPAC name is 6-chloro-2-(4-methoxy-2,6-dimethylphenyl)imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name6-chloro-2-(4-methoxy-2,6-dimethylphenyl)imidazo[1,2-a]pyridin-3-amine
PubChem CID82530170
Molecular FormulaC16H16ClN3O
Molecular Weight301.78 g/mol
Exact Mass301.10
IUPAC Name6-chloro-2-(4-methoxy-2,6-dimethylphenyl)imidazo[1,2-a]pyridin-3-amine
SMILESCOc1cc(C)c(-c2nc3ccc(Cl)cn3c2N)c(C)c1
InChIInChI=1S/C16H16ClN3O/c1-9-6-12(21-3)7-10(2)14(9)15-16(18)20-8-11(17)4-5-13(20)19-15/h4-8H,18H2,1-3H3
InChIKeyOKAJYHFBNFUVID-UHFFFAOYSA-N
XLogP3.86
TPSA52.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.78
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-(4-methoxy-2,6-dimethylphenyl)imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 6-chloro-2-(4-methoxy-2,6-dimethylphenyl)imidazo[1,2-a]pyridin-3-amine (CID 82530170) is 6-chloro-2-(4-methoxy-2,6-dimethylphenyl)imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 6-chloro-2-(4-methoxy-2,6-dimethylphenyl)imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 6-chloro-2-(4-methoxy-2,6-dimethylphenyl)imidazo[1,2-a]pyridin-3-amine is COc1cc(C)c(-c2nc3ccc(Cl)cn3c2N)c(C)c1.
What is the InChIKey of 6-chloro-2-(4-methoxy-2,6-dimethylphenyl)imidazo[1,2-a]pyridin-3-amine?
The InChIKey is OKAJYHFBNFUVID-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClN3O/c1-9-6-12(21-3)7-10(2)14(9)15-16(18)20-8-11(17)4-5-13(20)19-15/h4-8H,18H2,1-3H3.
What are the key properties of 6-chloro-2-(4-methoxy-2,6-dimethylphenyl)imidazo[1,2-a]pyridin-3-amine?
6-chloro-2-(4-methoxy-2,6-dimethylphenyl)imidazo[1,2-a]pyridin-3-amine has a molecular weight of 301.78 g/mol, XLogP of 3.86, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-(4-methoxy-2,6-dimethylphenyl)imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 82530170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).