5-methoxy-6-methyl-1,5-dihydropyrrolo[2,3-c]pyridine

C9H12N2O — CID 142993180

IUPAC5-methoxy-6-methyl-1,5-dihydropyrrolo[2,3-c]pyridine
SMILESCOC1C=c2cc[nH]c2=CN1C
InChIInChI=1S/C9H12N2O/c1-11-6-8-7(3-4-10-8)5-9(11)12-2/h3-6,9-10H,1-2H3
InChIKeyDCGVBJRDSNONCV-UHFFFAOYSA-N
MW164.21 g/mol
LogP-0.55
Rot. Bonds1

About 5-methoxy-6-methyl-1,5-dihydropyrrolo[2,3-c]pyridine

5-methoxy-6-methyl-1,5-dihydropyrrolo[2,3-c]pyridine (PubChem CID 142993180) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is 5-methoxy-6-methyl-1,5-dihydropyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name5-methoxy-6-methyl-1,5-dihydropyrrolo[2,3-c]pyridine
PubChem CID142993180
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name5-methoxy-6-methyl-1,5-dihydropyrrolo[2,3-c]pyridine
SMILESCOC1C=c2cc[nH]c2=CN1C
InChIInChI=1S/C9H12N2O/c1-11-6-8-7(3-4-10-8)5-9(11)12-2/h3-6,9-10H,1-2H3
InChIKeyDCGVBJRDSNONCV-UHFFFAOYSA-N
XLogP-0.55
TPSA28.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 5-0.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-6-methyl-1,5-dihydropyrrolo[2,3-c]pyridine?
The IUPAC name of 5-methoxy-6-methyl-1,5-dihydropyrrolo[2,3-c]pyridine (CID 142993180) is 5-methoxy-6-methyl-1,5-dihydropyrrolo[2,3-c]pyridine.
What is the SMILES notation for 5-methoxy-6-methyl-1,5-dihydropyrrolo[2,3-c]pyridine?
The canonical SMILES for 5-methoxy-6-methyl-1,5-dihydropyrrolo[2,3-c]pyridine is COC1C=c2cc[nH]c2=CN1C.
What is the InChIKey of 5-methoxy-6-methyl-1,5-dihydropyrrolo[2,3-c]pyridine?
The InChIKey is DCGVBJRDSNONCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c1-11-6-8-7(3-4-10-8)5-9(11)12-2/h3-6,9-10H,1-2H3.
What are the key properties of 5-methoxy-6-methyl-1,5-dihydropyrrolo[2,3-c]pyridine?
5-methoxy-6-methyl-1,5-dihydropyrrolo[2,3-c]pyridine has a molecular weight of 164.21 g/mol, XLogP of -0.55, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-6-methyl-1,5-dihydropyrrolo[2,3-c]pyridine is sourced from PubChem (CID 142993180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).