(5-methyloxolan-2-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanone

C15H19NO2 — CID 115782292

IUPAC(5-methyloxolan-2-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanone
SMILESCC1CCC(C(=O)C2CCCc3cccnc32)O1
InChIInChI=1S/C15H19NO2/c1-10-7-8-13(18-10)15(17)12-6-2-4-11-5-3-9-16-14(11)12/h3,5,9-10,12-13H,2,4,6-8H2,1H3
InChIKeyJZPWTPNBXOLGEO-UHFFFAOYSA-N
MW245.32 g/mol
LogP2.64
Rot. Bonds2

About (5-methyloxolan-2-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanone

(5-methyloxolan-2-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanone (PubChem CID 115782292) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is (5-methyloxolan-2-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanone.

Molecular Properties

Compound Name(5-methyloxolan-2-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanone
PubChem CID115782292
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name(5-methyloxolan-2-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanone
SMILESCC1CCC(C(=O)C2CCCc3cccnc32)O1
InChIInChI=1S/C15H19NO2/c1-10-7-8-13(18-10)15(17)12-6-2-4-11-5-3-9-16-14(11)12/h3,5,9-10,12-13H,2,4,6-8H2,1H3
InChIKeyJZPWTPNBXOLGEO-UHFFFAOYSA-N
XLogP2.64
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5-methyloxolan-2-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanone?
The IUPAC name of (5-methyloxolan-2-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanone (CID 115782292) is (5-methyloxolan-2-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanone.
What is the SMILES notation for (5-methyloxolan-2-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanone?
The canonical SMILES for (5-methyloxolan-2-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanone is CC1CCC(C(=O)C2CCCc3cccnc32)O1.
What is the InChIKey of (5-methyloxolan-2-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanone?
The InChIKey is JZPWTPNBXOLGEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-10-7-8-13(18-10)15(17)12-6-2-4-11-5-3-9-16-14(11)12/h3,5,9-10,12-13H,2,4,6-8H2,1H3.
What are the key properties of (5-methyloxolan-2-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanone?
(5-methyloxolan-2-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanone has a molecular weight of 245.32 g/mol, XLogP of 2.64, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyloxolan-2-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanone is sourced from PubChem (CID 115782292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).