[4-(ethylamino)oxolan-3-yl]-(5,6,7,8-tetrahydroquinolin-8-yl)methanone

C16H22N2O2 — CID 116588073

IUPAC[4-(ethylamino)oxolan-3-yl]-(5,6,7,8-tetrahydroquinolin-8-yl)methanone
SMILESCCNC1COCC1C(=O)C1CCCc2cccnc21
InChIInChI=1S/C16H22N2O2/c1-2-17-14-10-20-9-13(14)16(19)12-7-3-5-11-6-4-8-18-15(11)12/h4,6,8,12-14,17H,2-3,5,7,9-10H2,1H3
InChIKeyAOWQYLUUOBDWEI-UHFFFAOYSA-N
MW274.36 g/mol
LogP1.70
Rot. Bonds4

About [4-(ethylamino)oxolan-3-yl]-(5,6,7,8-tetrahydroquinolin-8-yl)methanone

[4-(ethylamino)oxolan-3-yl]-(5,6,7,8-tetrahydroquinolin-8-yl)methanone (PubChem CID 116588073) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is [4-(ethylamino)oxolan-3-yl]-(5,6,7,8-tetrahydroquinolin-8-yl)methanone.

Molecular Properties

Compound Name[4-(ethylamino)oxolan-3-yl]-(5,6,7,8-tetrahydroquinolin-8-yl)methanone
PubChem CID116588073
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name[4-(ethylamino)oxolan-3-yl]-(5,6,7,8-tetrahydroquinolin-8-yl)methanone
SMILESCCNC1COCC1C(=O)C1CCCc2cccnc21
InChIInChI=1S/C16H22N2O2/c1-2-17-14-10-20-9-13(14)16(19)12-7-3-5-11-6-4-8-18-15(11)12/h4,6,8,12-14,17H,2-3,5,7,9-10H2,1H3
InChIKeyAOWQYLUUOBDWEI-UHFFFAOYSA-N
XLogP1.70
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [4-(ethylamino)oxolan-3-yl]-(5,6,7,8-tetrahydroquinolin-8-yl)methanone with MolForge

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Related Compounds

2-oxo-2-(5,6,7,8-tetrahydroquinolin-8-yl)acetic acid
CID 130855424
(5-methyloxolan-2-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanone
CID 115782292
2-methylsulfonyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanone
CID 115782115
4-(methylamino)-1-(5,6,7,8-tetrahydroquinolin-8-yl)butan-1-one
CID 116555632
(5-ethylfuran-2-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanone
CID 115782095
3-methoxy-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-one
CID 79745653
4-chloro-1-(5,6,7,8-tetrahydroquinolin-8-yl)butan-1-one
CID 79745424
3-amino-2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butan-1-one
CID 116612266
[4-(ethylamino)oxolan-3-yl]-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone
CID 66257574
3-cyclohexyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-one
CID 115782065
(2-methyl-3-pyridinyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanone
CID 105114230
N-[(8R)-5,6,7,8-tetrahydroquinolin-8-yl]propanamide
CID 165447452

Frequently Asked Questions

What is the IUPAC name of [4-(ethylamino)oxolan-3-yl]-(5,6,7,8-tetrahydroquinolin-8-yl)methanone?
The IUPAC name of [4-(ethylamino)oxolan-3-yl]-(5,6,7,8-tetrahydroquinolin-8-yl)methanone (CID 116588073) is [4-(ethylamino)oxolan-3-yl]-(5,6,7,8-tetrahydroquinolin-8-yl)methanone.
What is the SMILES notation for [4-(ethylamino)oxolan-3-yl]-(5,6,7,8-tetrahydroquinolin-8-yl)methanone?
The canonical SMILES for [4-(ethylamino)oxolan-3-yl]-(5,6,7,8-tetrahydroquinolin-8-yl)methanone is CCNC1COCC1C(=O)C1CCCc2cccnc21.
What is the InChIKey of [4-(ethylamino)oxolan-3-yl]-(5,6,7,8-tetrahydroquinolin-8-yl)methanone?
The InChIKey is AOWQYLUUOBDWEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-2-17-14-10-20-9-13(14)16(19)12-7-3-5-11-6-4-8-18-15(11)12/h4,6,8,12-14,17H,2-3,5,7,9-10H2,1H3.
What are the key properties of [4-(ethylamino)oxolan-3-yl]-(5,6,7,8-tetrahydroquinolin-8-yl)methanone?
[4-(ethylamino)oxolan-3-yl]-(5,6,7,8-tetrahydroquinolin-8-yl)methanone has a molecular weight of 274.36 g/mol, XLogP of 1.70, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(ethylamino)oxolan-3-yl]-(5,6,7,8-tetrahydroquinolin-8-yl)methanone is sourced from PubChem (CID 116588073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).