3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine

C16H18N4O — CID 115322450

IUPAC3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine
SMILESCCc1ccccc1Cn1c(N)nc2ccc(OC)nc21
InChIInChI=1S/C16H18N4O/c1-3-11-6-4-5-7-12(11)10-20-15-13(18-16(20)17)8-9-14(19-15)21-2/h4-9H,3,10H2,1-2H3,(H2,17,18)
InChIKeyRMDFTBYWRYJRSB-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.63
Rot. Bonds4

About 3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine

3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine (PubChem CID 115322450) has the molecular formula C16H18N4O and a molecular weight of 282.35 g/mol. Its IUPAC name is 3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine
PubChem CID115322450
Molecular FormulaC16H18N4O
Molecular Weight282.35 g/mol
Exact Mass282.15
IUPAC Name3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine
SMILESCCc1ccccc1Cn1c(N)nc2ccc(OC)nc21
InChIInChI=1S/C16H18N4O/c1-3-11-6-4-5-7-12(11)10-20-15-13(18-16(20)17)8-9-14(19-15)21-2/h4-9H,3,10H2,1-2H3,(H2,17,18)
InChIKeyRMDFTBYWRYJRSB-UHFFFAOYSA-N
XLogP2.63
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-methoxy-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridin-2-amine
CID 115322105
5-methoxy-3-(2-methoxypropyl)imidazo[4,5-b]pyridin-2-amine
CID 102699356
5-methoxy-3-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridin-2-amine
CID 113286867
5-methoxy-3-(2-propylphenyl)imidazo[4,5-b]pyridin-2-amine
CID 115322301
5-methoxy-3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine
CID 115322294
3-[2-(dimethylamino)ethyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine
CID 115322083
2-(chloromethyl)-3-[(2-chlorophenyl)methyl]-5-methoxyimidazo[4,5-b]pyridine
CID 115322536
ethyl 4-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)butanoate
CID 115322446
5-bromo-1-[(2-ethylphenyl)methyl]benzimidazol-2-amine
CID 64696156
5-methoxy-3-(3-methylsulfanylpropyl)imidazo[4,5-b]pyridin-2-amine
CID 115322427
N-[2-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)ethyl]methanesulfonamide
CID 115322213
3-(cyclohexylmethyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine
CID 115322201

Frequently Asked Questions

What is the IUPAC name of 3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine (CID 115322450) is 3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine is CCc1ccccc1Cn1c(N)nc2ccc(OC)nc21.
What is the InChIKey of 3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine?
The InChIKey is RMDFTBYWRYJRSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O/c1-3-11-6-4-5-7-12(11)10-20-15-13(18-16(20)17)8-9-14(19-15)21-2/h4-9H,3,10H2,1-2H3,(H2,17,18).
What are the key properties of 3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine?
3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine has a molecular weight of 282.35 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 115322450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).