2-[2-(4-methoxy-2-pyridinyl)ethyl]-5,7-dimethyl-1H-imidazo[4,5-b]pyridine

C16H18N4O — CID 10286162

IUPAC2-[2-(4-methoxy-2-pyridinyl)ethyl]-5,7-dimethyl-1H-imidazo[4,5-b]pyridine
SMILESCOc1ccnc(CCc2nc3nc(C)cc(C)c3[nH]2)c1
InChIInChI=1S/C16H18N4O/c1-10-8-11(2)18-16-15(10)19-14(20-16)5-4-12-9-13(21-3)6-7-17-12/h6-9H,4-5H2,1-3H3,(H,18,19,20)
InChIKeyWTIYHTZINRBDAQ-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.76
Rot. Bonds4

About 2-[2-(4-methoxy-2-pyridinyl)ethyl]-5,7-dimethyl-1H-imidazo[4,5-b]pyridine

2-[2-(4-methoxy-2-pyridinyl)ethyl]-5,7-dimethyl-1H-imidazo[4,5-b]pyridine (PubChem CID 10286162) has the molecular formula C16H18N4O and a molecular weight of 282.35 g/mol. Its IUPAC name is 2-[2-(4-methoxy-2-pyridinyl)ethyl]-5,7-dimethyl-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-[2-(4-methoxy-2-pyridinyl)ethyl]-5,7-dimethyl-1H-imidazo[4,5-b]pyridine
PubChem CID10286162
Molecular FormulaC16H18N4O
Molecular Weight282.35 g/mol
Exact Mass282.15
IUPAC Name2-[2-(4-methoxy-2-pyridinyl)ethyl]-5,7-dimethyl-1H-imidazo[4,5-b]pyridine
SMILESCOc1ccnc(CCc2nc3nc(C)cc(C)c3[nH]2)c1
InChIInChI=1S/C16H18N4O/c1-10-8-11(2)18-16-15(10)19-14(20-16)5-4-12-9-13(21-3)6-7-17-12/h6-9H,4-5H2,1-3H3,(H,18,19,20)
InChIKeyWTIYHTZINRBDAQ-UHFFFAOYSA-N
XLogP2.76
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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2-(2,4-Dimethoxyphenyl)-3H-imidazo(4,5-b)pyridine
CID 156890
5-(4-Methoxyphenyl)-2-phenyl-1H-imidazole
CID 12024852
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CID 3086676
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CID 5329342

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-methoxy-2-pyridinyl)ethyl]-5,7-dimethyl-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-[2-(4-methoxy-2-pyridinyl)ethyl]-5,7-dimethyl-1H-imidazo[4,5-b]pyridine (CID 10286162) is 2-[2-(4-methoxy-2-pyridinyl)ethyl]-5,7-dimethyl-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-[2-(4-methoxy-2-pyridinyl)ethyl]-5,7-dimethyl-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-[2-(4-methoxy-2-pyridinyl)ethyl]-5,7-dimethyl-1H-imidazo[4,5-b]pyridine is COc1ccnc(CCc2nc3nc(C)cc(C)c3[nH]2)c1.
What is the InChIKey of 2-[2-(4-methoxy-2-pyridinyl)ethyl]-5,7-dimethyl-1H-imidazo[4,5-b]pyridine?
The InChIKey is WTIYHTZINRBDAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O/c1-10-8-11(2)18-16-15(10)19-14(20-16)5-4-12-9-13(21-3)6-7-17-12/h6-9H,4-5H2,1-3H3,(H,18,19,20).
What are the key properties of 2-[2-(4-methoxy-2-pyridinyl)ethyl]-5,7-dimethyl-1H-imidazo[4,5-b]pyridine?
2-[2-(4-methoxy-2-pyridinyl)ethyl]-5,7-dimethyl-1H-imidazo[4,5-b]pyridine has a molecular weight of 282.35 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-methoxy-2-pyridinyl)ethyl]-5,7-dimethyl-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 10286162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).