5,7-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine

C9H12N2 — CID 135256256

IUPAC5,7-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine
SMILESCc1cc(C)c2c(n1)CCN2
InChIInChI=1S/C9H12N2/c1-6-5-7(2)11-8-3-4-10-9(6)8/h5,10H,3-4H2,1-2H3
InChIKeySJMDWNKSTKHOML-UHFFFAOYSA-N
MW148.21 g/mol
LogP1.67
Rot. Bonds

About 5,7-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine

5,7-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine (PubChem CID 135256256) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 5,7-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine.

Molecular Properties

Compound Name5,7-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine
PubChem CID135256256
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name5,7-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine
SMILESCc1cc(C)c2c(n1)CCN2
InChIInChI=1S/C9H12N2/c1-6-5-7(2)11-8-3-4-10-9(6)8/h5,10H,3-4H2,1-2H3
InChIKeySJMDWNKSTKHOML-UHFFFAOYSA-N
XLogP1.67
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,7-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine?
The IUPAC name of 5,7-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine (CID 135256256) is 5,7-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine.
What is the SMILES notation for 5,7-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine?
The canonical SMILES for 5,7-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine is Cc1cc(C)c2c(n1)CCN2.
What is the InChIKey of 5,7-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine?
The InChIKey is SJMDWNKSTKHOML-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c1-6-5-7(2)11-8-3-4-10-9(6)8/h5,10H,3-4H2,1-2H3.
What are the key properties of 5,7-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine?
5,7-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine has a molecular weight of 148.21 g/mol, XLogP of 1.67, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine is sourced from PubChem (CID 135256256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).