2-(azetidin-1-yl)-6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine

C11H15N3 — CID 118974412

IUPAC2-(azetidin-1-yl)-6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine
SMILESCN1Cc2ccc(N3CCC3)nc2C1
InChIInChI=1S/C11H15N3/c1-13-7-9-3-4-11(12-10(9)8-13)14-5-2-6-14/h3-4H,2,5-8H2,1H3
InChIKeyPBNXQEUPRIJCAX-UHFFFAOYSA-N
MW189.26 g/mol
LogP1.24
Rot. Bonds1

About 2-(azetidin-1-yl)-6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine

2-(azetidin-1-yl)-6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine (PubChem CID 118974412) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 2-(azetidin-1-yl)-6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine.

Molecular Properties

Compound Name2-(azetidin-1-yl)-6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine
PubChem CID118974412
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name2-(azetidin-1-yl)-6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine
SMILESCN1Cc2ccc(N3CCC3)nc2C1
InChIInChI=1S/C11H15N3/c1-13-7-9-3-4-11(12-10(9)8-13)14-5-2-6-14/h3-4H,2,5-8H2,1H3
InChIKeyPBNXQEUPRIJCAX-UHFFFAOYSA-N
XLogP1.24
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-benzyl-2-(4-methylpiperazin-1-yl)-7,8-dihydro-5H-1,6-naphthyridine
CID 22335156
ethane;2-methoxy-6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine
CID 145047554
2-[4-(2-chloroethyl)-1,4-diazepan-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 113390959
2-methyl-6-nitro-2,3-dihydroimidazo[2,1-b][1,3]oxazole;6-methyl-2-piperidin-1-yl-7,8-dihydro-5H-1,6-naphthyridine
CID 145128318
1-(2-chloropyrimidin-4-yl)-4-methyl-1,4-diazepane
CID 62343451
2-methyl-5-pyrrolidin-1-yl-1,3-dihydroisoindole
CID 168515104
6-(azetidin-1-yl)-3-iodo-2-methylpyridine
CID 176729989
[6-(4-methyl-1,4-diazepan-1-yl)-2-pyridinyl]methanamine
CID 62300509
2-(azetidin-1-yl)-6-methylpyridine
CID 54182749
4-(6,7,8,9-tetrahydro-5H-pyrido[2,3-d]azepin-2-yl)-1,4-thiazepane 1,1-dioxide
CID 24959997
2-(azetidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-5-ol
CID 170542810
1-(5-bromo-2-pyridinyl)-4-methyl-1,4-diazepane
CID 59292213

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-1-yl)-6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine?
The IUPAC name of 2-(azetidin-1-yl)-6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine (CID 118974412) is 2-(azetidin-1-yl)-6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine.
What is the SMILES notation for 2-(azetidin-1-yl)-6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine?
The canonical SMILES for 2-(azetidin-1-yl)-6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine is CN1Cc2ccc(N3CCC3)nc2C1.
What is the InChIKey of 2-(azetidin-1-yl)-6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine?
The InChIKey is PBNXQEUPRIJCAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-13-7-9-3-4-11(12-10(9)8-13)14-5-2-6-14/h3-4H,2,5-8H2,1H3.
What are the key properties of 2-(azetidin-1-yl)-6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine?
2-(azetidin-1-yl)-6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine has a molecular weight of 189.26 g/mol, XLogP of 1.24, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-1-yl)-6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine is sourced from PubChem (CID 118974412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).