6-[2-(2-aminocyclopentyl)ethoxy]-3,4-dihydro-1H-quinolin-2-one

C16H22N2O2 — CID 79573107

IUPAC6-[2-(2-aminocyclopentyl)ethoxy]-3,4-dihydro-1H-quinolin-2-one
SMILESNC1CCCC1CCOc1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C16H22N2O2/c17-14-3-1-2-11(14)8-9-20-13-5-6-15-12(10-13)4-7-16(19)18-15/h5-6,10-11,14H,1-4,7-9,17H2,(H,18,19)
InChIKeyQJRDJGGQHLTXMC-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.47
Rot. Bonds4

About 6-[2-(2-aminocyclopentyl)ethoxy]-3,4-dihydro-1H-quinolin-2-one

6-[2-(2-aminocyclopentyl)ethoxy]-3,4-dihydro-1H-quinolin-2-one (PubChem CID 79573107) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 6-[2-(2-aminocyclopentyl)ethoxy]-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-[2-(2-aminocyclopentyl)ethoxy]-3,4-dihydro-1H-quinolin-2-one
PubChem CID79573107
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name6-[2-(2-aminocyclopentyl)ethoxy]-3,4-dihydro-1H-quinolin-2-one
SMILESNC1CCCC1CCOc1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C16H22N2O2/c17-14-3-1-2-11(14)8-9-20-13-5-6-15-12(10-13)4-7-16(19)18-15/h5-6,10-11,14H,1-4,7-9,17H2,(H,18,19)
InChIKeyQJRDJGGQHLTXMC-UHFFFAOYSA-N
XLogP2.47
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(2-aminocyclopentyl)ethoxy]-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-[2-(2-aminocyclopentyl)ethoxy]-3,4-dihydro-1H-quinolin-2-one (CID 79573107) is 6-[2-(2-aminocyclopentyl)ethoxy]-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-[2-(2-aminocyclopentyl)ethoxy]-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-[2-(2-aminocyclopentyl)ethoxy]-3,4-dihydro-1H-quinolin-2-one is NC1CCCC1CCOc1ccc2c(c1)CCC(=O)N2.
What is the InChIKey of 6-[2-(2-aminocyclopentyl)ethoxy]-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is QJRDJGGQHLTXMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c17-14-3-1-2-11(14)8-9-20-13-5-6-15-12(10-13)4-7-16(19)18-15/h5-6,10-11,14H,1-4,7-9,17H2,(H,18,19).
What are the key properties of 6-[2-(2-aminocyclopentyl)ethoxy]-3,4-dihydro-1H-quinolin-2-one?
6-[2-(2-aminocyclopentyl)ethoxy]-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 274.36 g/mol, XLogP of 2.47, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(2-aminocyclopentyl)ethoxy]-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 79573107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).