[3-(3,4-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine

C15H16N4 — CID 82481510

IUPAC[3-(3,4-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine
SMILESCc1ccc(-n2c(CN)nc3cccnc32)cc1C
InChIInChI=1S/C15H16N4/c1-10-5-6-12(8-11(10)2)19-14(9-16)18-13-4-3-7-17-15(13)19/h3-8H,9,16H2,1-2H3
InChIKeyYOIFAGRKBNCZJF-UHFFFAOYSA-N
MW252.32 g/mol
LogP2.50
Rot. Bonds2

About [3-(3,4-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine

[3-(3,4-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine (PubChem CID 82481510) has the molecular formula C15H16N4 and a molecular weight of 252.32 g/mol. Its IUPAC name is [3-(3,4-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine.

Molecular Properties

Compound Name[3-(3,4-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine
PubChem CID82481510
Molecular FormulaC15H16N4
Molecular Weight252.32 g/mol
Exact Mass252.14
IUPAC Name[3-(3,4-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine
SMILESCc1ccc(-n2c(CN)nc3cccnc32)cc1C
InChIInChI=1S/C15H16N4/c1-10-5-6-12(8-11(10)2)19-14(9-16)18-13-4-3-7-17-15(13)19/h3-8H,9,16H2,1-2H3
InChIKeyYOIFAGRKBNCZJF-UHFFFAOYSA-N
XLogP2.50
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[3-(3,4-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]ethanamine
CID 82487047
2-(chloromethyl)-3-(3,4-dimethylphenyl)imidazo[4,5-b]pyridine
CID 79293048
[3-(2,6-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine
CID 82481512
[3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine
CID 82487584
2-(chloromethyl)-3-(3-fluoro-4-methylphenyl)imidazo[4,5-b]pyridine
CID 79290101
2-(2-chloroethyl)-3-(4-methoxy-3-methylphenyl)imidazo[4,5-b]pyridine
CID 79274031
[3-(3-chloro-2-methylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine
CID 96668761
3-(4-methylphenyl)-2-[[3-(4-methylphenyl)imidazo[4,5-b]pyridin-2-yl]methoxymethyl]imidazo[4,5-b]pyridine
CID 20955885
[3-[(3-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methanamine
CID 53298848
2-[3-(3-methylphenyl)imidazo[4,5-b]pyridin-2-yl]ethanol
CID 117159986
3-[3-(3-methylphenyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
CID 117159732
2-(chloromethyl)-3-(5-chloro-2-methylphenyl)imidazo[4,5-b]pyridine
CID 79289697

Frequently Asked Questions

What is the IUPAC name of [3-(3,4-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine?
The IUPAC name of [3-(3,4-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine (CID 82481510) is [3-(3,4-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine.
What is the SMILES notation for [3-(3,4-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine?
The canonical SMILES for [3-(3,4-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine is Cc1ccc(-n2c(CN)nc3cccnc32)cc1C.
What is the InChIKey of [3-(3,4-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine?
The InChIKey is YOIFAGRKBNCZJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4/c1-10-5-6-12(8-11(10)2)19-14(9-16)18-13-4-3-7-17-15(13)19/h3-8H,9,16H2,1-2H3.
What are the key properties of [3-(3,4-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine?
[3-(3,4-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine has a molecular weight of 252.32 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(3,4-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine is sourced from PubChem (CID 82481510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).