3-ethyl-5-(7-methoxy-1H-indazol-3-yl)-1H-pyrrolo[2,3-b]pyridine

C17H16N4O — CID 166398526

IUPAC3-ethyl-5-(7-methoxy-1H-indazol-3-yl)-1H-pyrrolo[2,3-b]pyridine
SMILESCCc1c[nH]c2ncc(-c3n[nH]c4c(OC)cccc34)cc12
InChIInChI=1S/C17H16N4O/c1-3-10-8-18-17-13(10)7-11(9-19-17)15-12-5-4-6-14(22-2)16(12)21-20-15/h4-9H,3H2,1-2H3,(H,18,19)(H,20,21)
InChIKeyVZZNXCQUOLMCBJ-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.68
Rot. Bonds3

About 3-ethyl-5-(7-methoxy-1H-indazol-3-yl)-1H-pyrrolo[2,3-b]pyridine

3-ethyl-5-(7-methoxy-1H-indazol-3-yl)-1H-pyrrolo[2,3-b]pyridine (PubChem CID 166398526) has the molecular formula C17H16N4O and a molecular weight of 292.34 g/mol. Its IUPAC name is 3-ethyl-5-(7-methoxy-1H-indazol-3-yl)-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name3-ethyl-5-(7-methoxy-1H-indazol-3-yl)-1H-pyrrolo[2,3-b]pyridine
PubChem CID166398526
Molecular FormulaC17H16N4O
Molecular Weight292.34 g/mol
Exact Mass292.13
IUPAC Name3-ethyl-5-(7-methoxy-1H-indazol-3-yl)-1H-pyrrolo[2,3-b]pyridine
SMILESCCc1c[nH]c2ncc(-c3n[nH]c4c(OC)cccc34)cc12
InChIInChI=1S/C17H16N4O/c1-3-10-8-18-17-13(10)7-11(9-19-17)15-12-5-4-6-14(22-2)16(12)21-20-15/h4-9H,3H2,1-2H3,(H,18,19)(H,20,21)
InChIKeyVZZNXCQUOLMCBJ-UHFFFAOYSA-N
XLogP3.68
TPSA66.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(2-fluoro-3-methoxyphenyl)methyl]-5-[3-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine
CID 58087321
3-ethyl-5-[1-(2-methoxyethyl)pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridine
CID 166275142
[2-dimethylphosphoryl-4-(3-ethyl-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]methanol
CID 155462244
2-[[5-(3-ethyl-1H-pyrrolo[2,3-b]pyridin-5-yl)furan-2-carbonyl]amino]acetic acid
CID 166379250
5-(3-dimethylphosphoryl-5-methylphenyl)-3-ethyl-1H-pyrrolo[2,3-b]pyridine
CID 155462281
3-ethyl-5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine
CID 134232979
3-(2-methoxyphenyl)-5-(3-nitroso-1H-1,2,4-triazol-5-yl)-1H-pyrrolo[2,3-b]pyridine
CID 88967742
3-(3,4-dimethoxyphenyl)-5-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridine
CID 118709501
1-[3-[3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]-N-methylmethanamine
CID 123855828
4-[3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1H-pyridin-2-one
CID 11515215
2-[5-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]acetamide
CID 134806364
3-(2-methoxyphenyl)-5-(1H-pyrrol-3-yl)-1H-pyrrolo[2,3-b]pyridine
CID 59699759

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5-(7-methoxy-1H-indazol-3-yl)-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 3-ethyl-5-(7-methoxy-1H-indazol-3-yl)-1H-pyrrolo[2,3-b]pyridine (CID 166398526) is 3-ethyl-5-(7-methoxy-1H-indazol-3-yl)-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 3-ethyl-5-(7-methoxy-1H-indazol-3-yl)-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 3-ethyl-5-(7-methoxy-1H-indazol-3-yl)-1H-pyrrolo[2,3-b]pyridine is CCc1c[nH]c2ncc(-c3n[nH]c4c(OC)cccc34)cc12.
What is the InChIKey of 3-ethyl-5-(7-methoxy-1H-indazol-3-yl)-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is VZZNXCQUOLMCBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O/c1-3-10-8-18-17-13(10)7-11(9-19-17)15-12-5-4-6-14(22-2)16(12)21-20-15/h4-9H,3H2,1-2H3,(H,18,19)(H,20,21).
What are the key properties of 3-ethyl-5-(7-methoxy-1H-indazol-3-yl)-1H-pyrrolo[2,3-b]pyridine?
3-ethyl-5-(7-methoxy-1H-indazol-3-yl)-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 292.34 g/mol, XLogP of 3.68, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5-(7-methoxy-1H-indazol-3-yl)-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 166398526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).