6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine

C8H10N2 — CID 148886875

IUPAC6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
SMILESCC1=CC2NC=CC2N=C1
InChIInChI=1S/C8H10N2/c1-6-4-8-7(10-5-6)2-3-9-8/h2-5,7-9H,1H3
InChIKeyPEDLEHDAZDAIDI-UHFFFAOYSA-N
MW134.18 g/mol
LogP0.87
Rot. Bonds

About 6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine

6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine (PubChem CID 148886875) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is 6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine.

Molecular Properties

Compound Name6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
PubChem CID148886875
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC Name6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
SMILESCC1=CC2NC=CC2N=C1
InChIInChI=1S/C8H10N2/c1-6-4-8-7(10-5-6)2-3-9-8/h2-5,7-9H,1H3
InChIKeyPEDLEHDAZDAIDI-UHFFFAOYSA-N
XLogP0.87
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-6-fluoro-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
CID 117611844
6-fluoro-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
CID 118489342
6-fluoro-2-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
CID 118491774
3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
CID 17859413
7,7a-dihydro-1H-pyrrolo[2,3-c]pyridine
CID 17859506
2-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
CID 23545925
1,2,3,8a-Tetrahydro-1,6-naphthyridine
CID 91608146
2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
CID 118489343
2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-c]pyridine
CID 118489344
6-methyl-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
CID 118489361
2-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-c]pyridine
CID 118491772
2,6-dimethyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
CID 118491784

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine?
The IUPAC name of 6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine (CID 148886875) is 6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine.
What is the SMILES notation for 6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine?
The canonical SMILES for 6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine is CC1=CC2NC=CC2N=C1.
What is the InChIKey of 6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine?
The InChIKey is PEDLEHDAZDAIDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2/c1-6-4-8-7(10-5-6)2-3-9-8/h2-5,7-9H,1H3.
What are the key properties of 6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine?
6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine has a molecular weight of 134.18 g/mol, XLogP of 0.87, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine is sourced from PubChem (CID 148886875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).