1,6-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine

C9H12N2 — CID 21341307

IUPAC1,6-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine
SMILESCc1ccc2c(n1)N(C)CC2
InChIInChI=1S/C9H12N2/c1-7-3-4-8-5-6-11(2)9(8)10-7/h3-4H,5-6H2,1-2H3
InChIKeyVTGWNEGRUCDVSB-UHFFFAOYSA-N
MW148.21 g/mol
LogP1.38
Rot. Bonds

About 1,6-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine

1,6-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine (PubChem CID 21341307) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 1,6-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name1,6-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine
PubChem CID21341307
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name1,6-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine
SMILESCc1ccc2c(n1)N(C)CC2
InChIInChI=1S/C9H12N2/c1-7-3-4-8-5-6-11(2)9(8)10-7/h3-4H,5-6H2,1-2H3
InChIKeyVTGWNEGRUCDVSB-UHFFFAOYSA-N
XLogP1.38
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,6-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine?
The IUPAC name of 1,6-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine (CID 21341307) is 1,6-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine.
What is the SMILES notation for 1,6-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine?
The canonical SMILES for 1,6-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine is Cc1ccc2c(n1)N(C)CC2.
What is the InChIKey of 1,6-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine?
The InChIKey is VTGWNEGRUCDVSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c1-7-3-4-8-5-6-11(2)9(8)10-7/h3-4H,5-6H2,1-2H3.
What are the key properties of 1,6-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine?
1,6-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine has a molecular weight of 148.21 g/mol, XLogP of 1.38, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine is sourced from PubChem (CID 21341307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).