3-(2-methylmorpholine-4-carbonyl)-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one

C14H18N2O3 — CID 71894377

IUPAC3-(2-methylmorpholine-4-carbonyl)-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one
SMILESCC1CN(C(=O)c2cc3c([nH]c2=O)CCC3)CCO1
InChIInChI=1S/C14H18N2O3/c1-9-8-16(5-6-19-9)14(18)11-7-10-3-2-4-12(10)15-13(11)17/h7,9H,2-6,8H2,1H3,(H,15,17)
InChIKeyRZEHXMRHJYFKQJ-UHFFFAOYSA-N
MW262.31 g/mol
LogP0.72
Rot. Bonds1

About 3-(2-methylmorpholine-4-carbonyl)-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one

3-(2-methylmorpholine-4-carbonyl)-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one (PubChem CID 71894377) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is 3-(2-methylmorpholine-4-carbonyl)-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one.

Molecular Properties

Compound Name3-(2-methylmorpholine-4-carbonyl)-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one
PubChem CID71894377
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC Name3-(2-methylmorpholine-4-carbonyl)-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one
SMILESCC1CN(C(=O)c2cc3c([nH]c2=O)CCC3)CCO1
InChIInChI=1S/C14H18N2O3/c1-9-8-16(5-6-19-9)14(18)11-7-10-3-2-4-12(10)15-13(11)17/h7,9H,2-6,8H2,1H3,(H,15,17)
InChIKeyRZEHXMRHJYFKQJ-UHFFFAOYSA-N
XLogP0.72
TPSA62.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(2-methylmorpholine-4-carbonyl)-1,5,6,7-tetrahydrocyclopenta[b]pyridin-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

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylmorpholine-4-carbonyl)-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one?
The IUPAC name of 3-(2-methylmorpholine-4-carbonyl)-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one (CID 71894377) is 3-(2-methylmorpholine-4-carbonyl)-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one.
What is the SMILES notation for 3-(2-methylmorpholine-4-carbonyl)-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one?
The canonical SMILES for 3-(2-methylmorpholine-4-carbonyl)-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one is CC1CN(C(=O)c2cc3c([nH]c2=O)CCC3)CCO1.
What is the InChIKey of 3-(2-methylmorpholine-4-carbonyl)-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one?
The InChIKey is RZEHXMRHJYFKQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-9-8-16(5-6-19-9)14(18)11-7-10-3-2-4-12(10)15-13(11)17/h7,9H,2-6,8H2,1H3,(H,15,17).
What are the key properties of 3-(2-methylmorpholine-4-carbonyl)-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one?
3-(2-methylmorpholine-4-carbonyl)-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one has a molecular weight of 262.31 g/mol, XLogP of 0.72, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylmorpholine-4-carbonyl)-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one is sourced from PubChem (CID 71894377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).