7-cyclopentyloxy-6-pyridin-3-yl-3,4-dihydro-1H-quinolin-2-one

C19H20N2O2 — CID 66559935

IUPAC7-cyclopentyloxy-6-pyridin-3-yl-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(-c3cccnc3)c(OC3CCCC3)cc2N1
InChIInChI=1S/C19H20N2O2/c22-19-8-7-13-10-16(14-4-3-9-20-12-14)18(11-17(13)21-19)23-15-5-1-2-6-15/h3-4,9-12,15H,1-2,5-8H2,(H,21,22)
InChIKeyQQTBJUXWGVYTSE-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.95
Rot. Bonds3

About 7-cyclopentyloxy-6-pyridin-3-yl-3,4-dihydro-1H-quinolin-2-one

7-cyclopentyloxy-6-pyridin-3-yl-3,4-dihydro-1H-quinolin-2-one (PubChem CID 66559935) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is 7-cyclopentyloxy-6-pyridin-3-yl-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name7-cyclopentyloxy-6-pyridin-3-yl-3,4-dihydro-1H-quinolin-2-one
PubChem CID66559935
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name7-cyclopentyloxy-6-pyridin-3-yl-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(-c3cccnc3)c(OC3CCCC3)cc2N1
InChIInChI=1S/C19H20N2O2/c22-19-8-7-13-10-16(14-4-3-9-20-12-14)18(11-17(13)21-19)23-15-5-1-2-6-15/h3-4,9-12,15H,1-2,5-8H2,(H,21,22)
InChIKeyQQTBJUXWGVYTSE-UHFFFAOYSA-N
XLogP3.95
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-cyclopentyloxy-6-pyridin-3-yl-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 7-cyclopentyloxy-6-pyridin-3-yl-3,4-dihydro-1H-quinolin-2-one (CID 66559935) is 7-cyclopentyloxy-6-pyridin-3-yl-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 7-cyclopentyloxy-6-pyridin-3-yl-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 7-cyclopentyloxy-6-pyridin-3-yl-3,4-dihydro-1H-quinolin-2-one is O=C1CCc2cc(-c3cccnc3)c(OC3CCCC3)cc2N1.
What is the InChIKey of 7-cyclopentyloxy-6-pyridin-3-yl-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is QQTBJUXWGVYTSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c22-19-8-7-13-10-16(14-4-3-9-20-12-14)18(11-17(13)21-19)23-15-5-1-2-6-15/h3-4,9-12,15H,1-2,5-8H2,(H,21,22).
What are the key properties of 7-cyclopentyloxy-6-pyridin-3-yl-3,4-dihydro-1H-quinolin-2-one?
7-cyclopentyloxy-6-pyridin-3-yl-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 308.38 g/mol, XLogP of 3.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-cyclopentyloxy-6-pyridin-3-yl-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 66559935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).