ethane;1-methyl-2,3-dihydropyrrolo[2,3-b]pyridine

C12H22N2 — CID 143469071

IUPACethane;1-methyl-2,3-dihydropyrrolo[2,3-b]pyridine
SMILESCC.CC.CN1CCc2cccnc21
InChIInChI=1S/C8H10N2.2C2H6/c1-10-6-4-7-3-2-5-9-8(7)10;2*1-2/h2-3,5H,4,6H2,1H3;2*1-2H3
InChIKeyBAEKOCDLSFTKHB-UHFFFAOYSA-N
MW194.32 g/mol
LogP3.13
Rot. Bonds

About ethane;1-methyl-2,3-dihydropyrrolo[2,3-b]pyridine

ethane;1-methyl-2,3-dihydropyrrolo[2,3-b]pyridine (PubChem CID 143469071) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is ethane;1-methyl-2,3-dihydropyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Nameethane;1-methyl-2,3-dihydropyrrolo[2,3-b]pyridine
PubChem CID143469071
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Nameethane;1-methyl-2,3-dihydropyrrolo[2,3-b]pyridine
SMILESCC.CC.CN1CCc2cccnc21
InChIInChI=1S/C8H10N2.2C2H6/c1-10-6-4-7-3-2-5-9-8(7)10;2*1-2/h2-3,5H,4,6H2,1H3;2*1-2H3
InChIKeyBAEKOCDLSFTKHB-UHFFFAOYSA-N
XLogP3.13
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze ethane;1-methyl-2,3-dihydropyrrolo[2,3-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

ethane;1-methyl-3,4-dihydro-2H-1,8-naphthyridine
CID 91237685
ethane;bis(1-methyl-3,4-dihydro-2H-1,8-naphthyridine);bis(2-methylpropane)
CID 159492858
1-methyl-4-pyridin-2-yl-3,5-dihydro-2H-pyrido[2,3-e][1,4]diazepine
CID 97411735
1-ethenyl-2,3-dihydropyrrolo[2,3-b]pyridine
CID 156720618
4-methyl-2,3-dihydro-1H-pyrido[2,3-b]pyrazine
CID 50742427
3-[3-(bromomethyl)-2-pyridinyl]-1,2,4,5-tetrahydro-3-benzazepine
CID 114056963
1,6-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine
CID 21341307
1-(3-cyclopropyl-1-methylpyrazol-5-yl)-2,3-dihydropyrrolo[2,3-b]pyridine
CID 141216188
1-(3-methyl-2-pyridinyl)-2,3-dihydroindole
CID 143449251
1-piperidin-4-yl-2,3-dihydropyrrolo[2,3-b]pyridine
CID 117223926
1-ethyl-4-methyl-2,3-dihydropyrido[2,3-b]pyrazine
CID 127763309
1-methyl-4-(3-methyl-2-pyridinyl)piperazine
CID 46739573

Frequently Asked Questions

What is the IUPAC name of ethane;1-methyl-2,3-dihydropyrrolo[2,3-b]pyridine?
The IUPAC name of ethane;1-methyl-2,3-dihydropyrrolo[2,3-b]pyridine (CID 143469071) is ethane;1-methyl-2,3-dihydropyrrolo[2,3-b]pyridine.
What is the SMILES notation for ethane;1-methyl-2,3-dihydropyrrolo[2,3-b]pyridine?
The canonical SMILES for ethane;1-methyl-2,3-dihydropyrrolo[2,3-b]pyridine is CC.CC.CN1CCc2cccnc21.
What is the InChIKey of ethane;1-methyl-2,3-dihydropyrrolo[2,3-b]pyridine?
The InChIKey is BAEKOCDLSFTKHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2.2C2H6/c1-10-6-4-7-3-2-5-9-8(7)10;2*1-2/h2-3,5H,4,6H2,1H3;2*1-2H3.
What are the key properties of ethane;1-methyl-2,3-dihydropyrrolo[2,3-b]pyridine?
ethane;1-methyl-2,3-dihydropyrrolo[2,3-b]pyridine has a molecular weight of 194.32 g/mol, XLogP of 3.13, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-methyl-2,3-dihydropyrrolo[2,3-b]pyridine is sourced from PubChem (CID 143469071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).