5-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-b]pyridine

C11H16N2 — CID 170012584

IUPAC5-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-b]pyridine
SMILESCC(C)N1Cc2ncccc2C1C
InChIInChI=1S/C11H16N2/c1-8(2)13-7-11-10(9(13)3)5-4-6-12-11/h4-6,8-9H,7H2,1-3H3
InChIKeyKKUWOGYLFYNKFP-UHFFFAOYSA-N
MW176.26 g/mol
LogP2.37
Rot. Bonds1

About 5-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-b]pyridine

5-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-b]pyridine (PubChem CID 170012584) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is 5-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-b]pyridine.

Molecular Properties

Compound Name5-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-b]pyridine
PubChem CID170012584
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name5-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-b]pyridine
SMILESCC(C)N1Cc2ncccc2C1C
InChIInChI=1S/C11H16N2/c1-8(2)13-7-11-10(9(13)3)5-4-6-12-11/h4-6,8-9H,7H2,1-3H3
InChIKeyKKUWOGYLFYNKFP-UHFFFAOYSA-N
XLogP2.37
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-b]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6,7-di(propan-2-yl)-7,8-dihydro-5H-1,6-naphthyridine
CID 165372700
5,6,7-trimethyl-5,7-dihydropyrrolo[3,4-b]pyridine
CID 59616840
(5S)-1'-propan-2-ylspiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine
CID 155623818
4-methyl-3-propan-2-yl-2,4-dihydro-1,3-benzoxazine
CID 12808442
(5R)-5,6-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 58714676
5-methyl-6,7-dihydro-5H-pyrrolo[3,4-b]pyridine
CID 147578197
5-methyl-5,7-dihydrocyclopenta[b]pyridin-6-one
CID 134558287
N-propan-2-yl-6,7-dihydro-5H-cyclopenta[b]pyridin-5-amine
CID 176861627
5,7-dimethyl-5,6,7,8-tetrahydro-1,6-naphthyridine
CID 83970782
N,N-di(propan-2-yl)-3-(1-propan-2-ylpiperidin-2-yl)pyridin-2-amine
CID 102540014
N-cyclohexyl-3-(1-propan-2-ylpiperidin-2-yl)pyridin-2-amine
CID 102540493
6-propan-2-yl-5,8-dihydropyrido[3,2-d]thiazine 7,7-dioxide
CID 67806203

Frequently Asked Questions

What is the IUPAC name of 5-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-b]pyridine?
The IUPAC name of 5-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-b]pyridine (CID 170012584) is 5-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-b]pyridine.
What is the SMILES notation for 5-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-b]pyridine?
The canonical SMILES for 5-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-b]pyridine is CC(C)N1Cc2ncccc2C1C.
What is the InChIKey of 5-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-b]pyridine?
The InChIKey is KKUWOGYLFYNKFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2/c1-8(2)13-7-11-10(9(13)3)5-4-6-12-11/h4-6,8-9H,7H2,1-3H3.
What are the key properties of 5-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-b]pyridine?
5-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-b]pyridine has a molecular weight of 176.26 g/mol, XLogP of 2.37, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-b]pyridine is sourced from PubChem (CID 170012584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).