1-(1-ethyl-3-methylpyrrolo[2,3-b]pyridin-6-yl)pyrrolidin-2-one

C14H17N3O — CID 163785731

IUPAC1-(1-ethyl-3-methylpyrrolo[2,3-b]pyridin-6-yl)pyrrolidin-2-one
SMILESCCn1cc(C)c2ccc(N3CCCC3=O)nc21
InChIInChI=1S/C14H17N3O/c1-3-16-9-10(2)11-6-7-12(15-14(11)16)17-8-4-5-13(17)18/h6-7,9H,3-5,8H2,1-2H3
InChIKeyMSIVSVFKQQCARF-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.49
Rot. Bonds2

About 1-(1-ethyl-3-methylpyrrolo[2,3-b]pyridin-6-yl)pyrrolidin-2-one

1-(1-ethyl-3-methylpyrrolo[2,3-b]pyridin-6-yl)pyrrolidin-2-one (PubChem CID 163785731) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is 1-(1-ethyl-3-methylpyrrolo[2,3-b]pyridin-6-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(1-ethyl-3-methylpyrrolo[2,3-b]pyridin-6-yl)pyrrolidin-2-one
PubChem CID163785731
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name1-(1-ethyl-3-methylpyrrolo[2,3-b]pyridin-6-yl)pyrrolidin-2-one
SMILESCCn1cc(C)c2ccc(N3CCCC3=O)nc21
InChIInChI=1S/C14H17N3O/c1-3-16-9-10(2)11-6-7-12(15-14(11)16)17-8-4-5-13(17)18/h6-7,9H,3-5,8H2,1-2H3
InChIKeyMSIVSVFKQQCARF-UHFFFAOYSA-N
XLogP2.49
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(1-ethyl-3-methylpyrrolo[2,3-b]pyridin-6-yl)pyrrolidin-2-one 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

1-(5-ethyl-6-methyl-2-pyridinyl)pyrrolidin-2-one
CID 166909775
ethane;1-(6-methyl-2-pyridinyl)pyrrolidin-2-one
CID 142348344
1-[2-methyl-4-(trifluoromethyl)imidazo[1,2-a][1,8]naphthyridin-8-yl]pyrrolidin-2-one
CID 90381743
1-(4-chloro-2-methylpyrido[3,2-d]pyrimidin-6-yl)pyrrolidin-2-one
CID 178130696
1-[6-(trifluoromethyl)-2-pyridinyl]pyrrolidin-2-one
CID 166608825
1-(2-methyl-4-sulfanylidene-1H-pyrido[3,2-d]pyrimidin-6-yl)pyrrolidin-2-one
CID 178131059
1-[2-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)ethenyl]-1-(2,2,2-trifluoroethyl)imidazol-4-yl]pyrrolidin-2-one
CID 123939996
1-(6-iodo-2-pyridinyl)pyrrolidin-2-one
CID 146969980
1-(5-methyl-2-pyridinyl)piperidin-2-one
CID 58622812
1-(1-methylpyrazol-3-yl)pyrrolidin-2-one
CID 50742723
1-ethyl-3-iodo-7-methyl-1,8-naphthyridin-4-one
CID 10470853
1-(6-bromo-3-methyl-2-pyridinyl)pyrrolidin-2-one
CID 177346413

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethyl-3-methylpyrrolo[2,3-b]pyridin-6-yl)pyrrolidin-2-one?
The IUPAC name of 1-(1-ethyl-3-methylpyrrolo[2,3-b]pyridin-6-yl)pyrrolidin-2-one (CID 163785731) is 1-(1-ethyl-3-methylpyrrolo[2,3-b]pyridin-6-yl)pyrrolidin-2-one.
What is the SMILES notation for 1-(1-ethyl-3-methylpyrrolo[2,3-b]pyridin-6-yl)pyrrolidin-2-one?
The canonical SMILES for 1-(1-ethyl-3-methylpyrrolo[2,3-b]pyridin-6-yl)pyrrolidin-2-one is CCn1cc(C)c2ccc(N3CCCC3=O)nc21.
What is the InChIKey of 1-(1-ethyl-3-methylpyrrolo[2,3-b]pyridin-6-yl)pyrrolidin-2-one?
The InChIKey is MSIVSVFKQQCARF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-3-16-9-10(2)11-6-7-12(15-14(11)16)17-8-4-5-13(17)18/h6-7,9H,3-5,8H2,1-2H3.
What are the key properties of 1-(1-ethyl-3-methylpyrrolo[2,3-b]pyridin-6-yl)pyrrolidin-2-one?
1-(1-ethyl-3-methylpyrrolo[2,3-b]pyridin-6-yl)pyrrolidin-2-one has a molecular weight of 243.31 g/mol, XLogP of 2.49, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethyl-3-methylpyrrolo[2,3-b]pyridin-6-yl)pyrrolidin-2-one is sourced from PubChem (CID 163785731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).