3,4-dihydro-2H-quinolin-1-yl(oxan-3-yl)methanone

C15H19NO2 — CID 71879683

IUPAC3,4-dihydro-2H-quinolin-1-yl(oxan-3-yl)methanone
SMILESO=C(C1CCCOC1)N1CCCc2ccccc21
InChIInChI=1S/C15H19NO2/c17-15(13-7-4-10-18-11-13)16-9-3-6-12-5-1-2-8-14(12)16/h1-2,5,8,13H,3-4,6-7,9-11H2
InChIKeyRHDGNOPDDUXQCO-UHFFFAOYSA-N
MW245.32 g/mol
LogP2.39
Rot. Bonds1

About 3,4-dihydro-2H-quinolin-1-yl(oxan-3-yl)methanone

3,4-dihydro-2H-quinolin-1-yl(oxan-3-yl)methanone (PubChem CID 71879683) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is 3,4-dihydro-2H-quinolin-1-yl(oxan-3-yl)methanone.

Molecular Properties

Compound Name3,4-dihydro-2H-quinolin-1-yl(oxan-3-yl)methanone
PubChem CID71879683
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name3,4-dihydro-2H-quinolin-1-yl(oxan-3-yl)methanone
SMILESO=C(C1CCCOC1)N1CCCc2ccccc21
InChIInChI=1S/C15H19NO2/c17-15(13-7-4-10-18-11-13)16-9-3-6-12-5-1-2-8-14(12)16/h1-2,5,8,13H,3-4,6-7,9-11H2
InChIKeyRHDGNOPDDUXQCO-UHFFFAOYSA-N
XLogP2.39
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(5-amino-3,4-dihydro-2H-quinolin-1-yl)-(oxan-3-yl)methanone
CID 82705671
[(3S)-oxan-3-yl]-[4-(2,2,2-trifluoroethyl)-2,3-dihydroquinoxalin-1-yl]methanone
CID 97017229
3,4-dihydro-2H-quinolin-1-yl-(1,1-dioxothian-3-yl)methanone
CID 110857121
3-(3,4-dihydro-2H-quinoline-1-carbonyl)cyclobutane-1-carboxylic acid
CID 139695348
(4S)-4-(3,4-dihydro-2H-quinoline-1-carbonyl)-1-(oxan-4-yl)pyrrolidin-2-one
CID 97040954
(1S,5S)-3-(3,4-dihydro-2H-quinoline-1-carbonyl)bicyclo[3.3.1]nonan-9-one
CID 98294897
(6,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone
CID 128950679
1-[3-(3,4-dihydro-2H-quinoline-1-carbonyl)piperidin-1-yl]-2,2-dimethylpropan-1-one
CID 47984287
oxolan-3-yl(1,2,3,4-tetrahydro-1,5-benzodiazepin-5-yl)methanone
CID 64851976
(2S)-1-(oxane-3-carbonyl)-2,3-dihydroindole-2-carboxylic acid
CID 62760682
3,4-dihydro-2H-chromen-4-yl(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 110649686
4-(3,4-dihydro-2H-quinoline-1-carbonyl)-1-(2-morpholin-4-ylethyl)pyrrolidin-2-one
CID 113182980

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-quinolin-1-yl(oxan-3-yl)methanone?
The IUPAC name of 3,4-dihydro-2H-quinolin-1-yl(oxan-3-yl)methanone (CID 71879683) is 3,4-dihydro-2H-quinolin-1-yl(oxan-3-yl)methanone.
What is the SMILES notation for 3,4-dihydro-2H-quinolin-1-yl(oxan-3-yl)methanone?
The canonical SMILES for 3,4-dihydro-2H-quinolin-1-yl(oxan-3-yl)methanone is O=C(C1CCCOC1)N1CCCc2ccccc21.
What is the InChIKey of 3,4-dihydro-2H-quinolin-1-yl(oxan-3-yl)methanone?
The InChIKey is RHDGNOPDDUXQCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c17-15(13-7-4-10-18-11-13)16-9-3-6-12-5-1-2-8-14(12)16/h1-2,5,8,13H,3-4,6-7,9-11H2.
What are the key properties of 3,4-dihydro-2H-quinolin-1-yl(oxan-3-yl)methanone?
3,4-dihydro-2H-quinolin-1-yl(oxan-3-yl)methanone has a molecular weight of 245.32 g/mol, XLogP of 2.39, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-quinolin-1-yl(oxan-3-yl)methanone is sourced from PubChem (CID 71879683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).