2-(2-oxo-2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydrocinnolin-3-one

C14H19N3O2 — CID 75465652

IUPAC2-(2-oxo-2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydrocinnolin-3-one
SMILESO=C(Cn1nc2c(cc1=O)CCCC2)N1CCCC1
InChIInChI=1S/C14H19N3O2/c18-13-9-11-5-1-2-6-12(11)15-17(13)10-14(19)16-7-3-4-8-16/h9H,1-8,10H2
InChIKeyKZDGEAOGNOBNAV-UHFFFAOYSA-N
MW261.32 g/mol
LogP0.74
Rot. Bonds2

About 2-(2-oxo-2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydrocinnolin-3-one

2-(2-oxo-2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydrocinnolin-3-one (PubChem CID 75465652) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 2-(2-oxo-2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydrocinnolin-3-one.

Molecular Properties

Compound Name2-(2-oxo-2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydrocinnolin-3-one
PubChem CID75465652
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name2-(2-oxo-2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydrocinnolin-3-one
SMILESO=C(Cn1nc2c(cc1=O)CCCC2)N1CCCC1
InChIInChI=1S/C14H19N3O2/c18-13-9-11-5-1-2-6-12(11)15-17(13)10-14(19)16-7-3-4-8-16/h9H,1-8,10H2
InChIKeyKZDGEAOGNOBNAV-UHFFFAOYSA-N
XLogP0.74
TPSA55.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(2-oxo-2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydrocinnolin-3-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

2-methyl-6-[2-(2-oxopyrrolidin-1-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
CID 71870932
N-(3-Methylbutyl)-2-(3-oxo-2,3,5,6,7,8-hexahydrocinnolin-2-YL)acetamide
CID 47004347
N-((1-ethylpyrrolidin-2-yl)methyl)-2-(3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetamide
CID 71709367
2-[2-(3-Methylpiperidin-1-yl)-2-oxoethyl]-5,6,7,8-tetrahydrocinnolin-3-one
CID 51072395
2-[2-(4-Methylpiperidin-1-yl)-2-oxoethyl]-5,6,7,8-tetrahydrocinnolin-3-one
CID 51072396
2-[2-(2-Methylpiperidin-1-yl)-2-oxoethyl]-5,6,7,8-tetrahydrocinnolin-3-one
CID 51072398
2-[2-(Azepan-1-yl)-2-oxoethyl]-5,6,7,8-tetrahydrocinnolin-3-one
CID 53518010
2-(2-Oxo-2-piperidin-1-ylethyl)-5,6,7,8-tetrahydrocinnolin-3-one
CID 53528476
2-[2-Oxo-2-(pyrrolidin-1-yl)ethyl]-2H,3H,5H,6H,7H,8H-pyrido[4,3-c]pyridazin-3-one
CID 55168743
2-[2-oxo-2-(1-pyrrolidinyl)ethyl]-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
CID 60174816
2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2H,3H,5H,6H,7H,8H-pyrido[4,3-c]pyridazin-3-one hydrochloride
CID 71755884
5,6-dimethyl-2-(2-oxo-2-{2-[2-(1-pyrrolidinyl)ethyl]-1-piperidinyl}ethyl)-3(2H)-pyridazinone
CID 72886096

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxo-2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydrocinnolin-3-one?
The IUPAC name of 2-(2-oxo-2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydrocinnolin-3-one (CID 75465652) is 2-(2-oxo-2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydrocinnolin-3-one.
What is the SMILES notation for 2-(2-oxo-2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydrocinnolin-3-one?
The canonical SMILES for 2-(2-oxo-2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydrocinnolin-3-one is O=C(Cn1nc2c(cc1=O)CCCC2)N1CCCC1.
What is the InChIKey of 2-(2-oxo-2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydrocinnolin-3-one?
The InChIKey is KZDGEAOGNOBNAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c18-13-9-11-5-1-2-6-12(11)15-17(13)10-14(19)16-7-3-4-8-16/h9H,1-8,10H2.
What are the key properties of 2-(2-oxo-2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydrocinnolin-3-one?
2-(2-oxo-2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydrocinnolin-3-one has a molecular weight of 261.32 g/mol, XLogP of 0.74, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydrocinnolin-3-one is sourced from PubChem (CID 75465652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).