1,2-oxazolidin-2-yl(1,2,3,4-tetrahydroquinolin-3-yl)methanone

C13H16N2O2 — CID 106901703

IUPAC1,2-oxazolidin-2-yl(1,2,3,4-tetrahydroquinolin-3-yl)methanone
SMILESO=C(C1CNc2ccccc2C1)N1CCCO1
InChIInChI=1S/C13H16N2O2/c16-13(15-6-3-7-17-15)11-8-10-4-1-2-5-12(10)14-9-11/h1-2,4-5,11,14H,3,6-9H2
InChIKeyIQHVWEBIFGPLKK-UHFFFAOYSA-N
MW232.28 g/mol
LogP1.43
Rot. Bonds1

About 1,2-oxazolidin-2-yl(1,2,3,4-tetrahydroquinolin-3-yl)methanone

1,2-oxazolidin-2-yl(1,2,3,4-tetrahydroquinolin-3-yl)methanone (PubChem CID 106901703) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is 1,2-oxazolidin-2-yl(1,2,3,4-tetrahydroquinolin-3-yl)methanone.

Molecular Properties

Compound Name1,2-oxazolidin-2-yl(1,2,3,4-tetrahydroquinolin-3-yl)methanone
PubChem CID106901703
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name1,2-oxazolidin-2-yl(1,2,3,4-tetrahydroquinolin-3-yl)methanone
SMILESO=C(C1CNc2ccccc2C1)N1CCCO1
InChIInChI=1S/C13H16N2O2/c16-13(15-6-3-7-17-15)11-8-10-4-1-2-5-12(10)14-9-11/h1-2,4-5,11,14H,3,6-9H2
InChIKeyIQHVWEBIFGPLKK-UHFFFAOYSA-N
XLogP1.43
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-1,2,3,4-tetrahydroquinoline-3-carboxylic acid
CID 34181194
(3S)-1-(1,2,3,4-tetrahydroquinoline-3-carbonyl)piperidine-3-carboxylic acid
CID 106901635
(3,4-dimethylpyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinolin-3-yl)methanone
CID 79180699
8-oxa-3-azabicyclo[3.2.1]octan-3-yl(1,2,3,4-tetrahydroquinolin-3-yl)methanone
CID 66369499
1,2-oxazolidin-2-yl(1,2,3,4-tetrahydroisoquinolin-3-yl)methanone
CID 113375553
[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-(1,2,3,4-tetrahydroquinolin-3-yl)methanone
CID 102933003
[3-(methoxymethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroquinolin-3-yl)methanone
CID 106586999
2-[1-(1,2,3,4-tetrahydroquinoline-3-carbonyl)azetidin-3-yl]acetic acid
CID 106901528
(1-methylpiperidin-4-yl) 1,2,3,4-tetrahydroquinoline-3-carboxylate
CID 106902774
N-cyclobutyl-N-methyl-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901759
cyclohexyl 1,2,3,4-tetrahydroquinoline-3-carboxylate
CID 106902751
[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]-(1,2,3,4-tetrahydroquinolin-3-yl)methanone
CID 106901792

Frequently Asked Questions

What is the IUPAC name of 1,2-oxazolidin-2-yl(1,2,3,4-tetrahydroquinolin-3-yl)methanone?
The IUPAC name of 1,2-oxazolidin-2-yl(1,2,3,4-tetrahydroquinolin-3-yl)methanone (CID 106901703) is 1,2-oxazolidin-2-yl(1,2,3,4-tetrahydroquinolin-3-yl)methanone.
What is the SMILES notation for 1,2-oxazolidin-2-yl(1,2,3,4-tetrahydroquinolin-3-yl)methanone?
The canonical SMILES for 1,2-oxazolidin-2-yl(1,2,3,4-tetrahydroquinolin-3-yl)methanone is O=C(C1CNc2ccccc2C1)N1CCCO1.
What is the InChIKey of 1,2-oxazolidin-2-yl(1,2,3,4-tetrahydroquinolin-3-yl)methanone?
The InChIKey is IQHVWEBIFGPLKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c16-13(15-6-3-7-17-15)11-8-10-4-1-2-5-12(10)14-9-11/h1-2,4-5,11,14H,3,6-9H2.
What are the key properties of 1,2-oxazolidin-2-yl(1,2,3,4-tetrahydroquinolin-3-yl)methanone?
1,2-oxazolidin-2-yl(1,2,3,4-tetrahydroquinolin-3-yl)methanone has a molecular weight of 232.28 g/mol, XLogP of 1.43, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-oxazolidin-2-yl(1,2,3,4-tetrahydroquinolin-3-yl)methanone is sourced from PubChem (CID 106901703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).