4-methyl-2,3-dihydro-1H-pyrrolo[3,4-b]pyridine

C8H10N2 — CID 19826811

IUPAC4-methyl-2,3-dihydro-1H-pyrrolo[3,4-b]pyridine
SMILESCC1=C2C=NC=C2NCC1
InChIInChI=1S/C8H10N2/c1-6-2-3-10-8-5-9-4-7(6)8/h4-5,10H,2-3H2,1H3
InChIKeyKGVRFXMZSIBAFX-UHFFFAOYSA-N
MW134.18 g/mol
LogP1.22
Rot. Bonds

About 4-methyl-2,3-dihydro-1H-pyrrolo[3,4-b]pyridine

4-methyl-2,3-dihydro-1H-pyrrolo[3,4-b]pyridine (PubChem CID 19826811) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is 4-methyl-2,3-dihydro-1H-pyrrolo[3,4-b]pyridine.

Molecular Properties

Compound Name4-methyl-2,3-dihydro-1H-pyrrolo[3,4-b]pyridine
PubChem CID19826811
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC Name4-methyl-2,3-dihydro-1H-pyrrolo[3,4-b]pyridine
SMILESCC1=C2C=NC=C2NCC1
InChIInChI=1S/C8H10N2/c1-6-2-3-10-8-5-9-4-7(6)8/h4-5,10H,2-3H2,1H3
InChIKeyKGVRFXMZSIBAFX-UHFFFAOYSA-N
XLogP1.22
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 ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3H-Pyrrolo[3,2-f]quinoline-1-methanamine, N,N-dimethyl-
CID 135530303
2,3-dihydro-1H-pyrrolo[3,4-b]pyridine
CID 17848339
2,4-dimethyl-2,3-dihydro-1H-pyrrolo[3,4-b]pyridine
CID 19826769
2,2,4-Trimethyl-1,3-dihydropyrrolo[3,4-b]pyridine
CID 22156640
3-[(Z)-1-amino-3-iminoprop-1-en-2-yl]-N-methyl-4aH-cyclopenta[b]pyridin-5-amine
CID 122667292
5-N-ethyl-6-methylideneisoindole-1,5-diamine
CID 123212757
6H-pyrrolo[3,2-f]quinolin-9-amine
CID 135778894
(Z)-4-imino-3-(1,2,3,6-tetrahydropyridin-5-yl)but-2-en-2-amine
CID 139358447
(4Z)-5-methyl-3-methylidene-6-methylimino-N-propylhexa-1,4-dien-2-amine
CID 139438549
(2E)-2-[(3E)-3-ethylidene-1H-pyrrol-2-ylidene]-N-methylpropan-1-imine
CID 143818470
1-[(4Z)-4-ethylidene-3-methyl-5-methylidene-1H-pyrrol-2-yl]-N-methylmethanimine
CID 144512537
Ethane;1-methyl-5,6-dihydropyrazolo[4,3-c]pyridine
CID 145323521

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2,3-dihydro-1H-pyrrolo[3,4-b]pyridine?
The IUPAC name of 4-methyl-2,3-dihydro-1H-pyrrolo[3,4-b]pyridine (CID 19826811) is 4-methyl-2,3-dihydro-1H-pyrrolo[3,4-b]pyridine.
What is the SMILES notation for 4-methyl-2,3-dihydro-1H-pyrrolo[3,4-b]pyridine?
The canonical SMILES for 4-methyl-2,3-dihydro-1H-pyrrolo[3,4-b]pyridine is CC1=C2C=NC=C2NCC1.
What is the InChIKey of 4-methyl-2,3-dihydro-1H-pyrrolo[3,4-b]pyridine?
The InChIKey is KGVRFXMZSIBAFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2/c1-6-2-3-10-8-5-9-4-7(6)8/h4-5,10H,2-3H2,1H3.
What are the key properties of 4-methyl-2,3-dihydro-1H-pyrrolo[3,4-b]pyridine?
4-methyl-2,3-dihydro-1H-pyrrolo[3,4-b]pyridine has a molecular weight of 134.18 g/mol, XLogP of 1.22, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2,3-dihydro-1H-pyrrolo[3,4-b]pyridine is sourced from PubChem (CID 19826811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).