8-[ethyl(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one

C13H20N2O2 — CID 13463811

IUPAC8-[ethyl(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one
SMILESCCN(CCO)C1CCCc2ccc(=O)[nH]c21
InChIInChI=1S/C13H20N2O2/c1-2-15(8-9-16)11-5-3-4-10-6-7-12(17)14-13(10)11/h6-7,11,16H,2-5,8-9H2,1H3,(H,14,17)
InChIKeyUTPWZTYSVFBBRG-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.07
Rot. Bonds4

About 8-[ethyl(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one

8-[ethyl(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one (PubChem CID 13463811) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 8-[ethyl(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one.

Molecular Properties

Compound Name8-[ethyl(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one
PubChem CID13463811
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name8-[ethyl(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one
SMILESCCN(CCO)C1CCCc2ccc(=O)[nH]c21
InChIInChI=1S/C13H20N2O2/c1-2-15(8-9-16)11-5-3-4-10-6-7-12(17)14-13(10)11/h6-7,11,16H,2-5,8-9H2,1H3,(H,14,17)
InChIKeyUTPWZTYSVFBBRG-UHFFFAOYSA-N
XLogP1.07
TPSA56.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-[ethyl(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one?
The IUPAC name of 8-[ethyl(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one (CID 13463811) is 8-[ethyl(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one.
What is the SMILES notation for 8-[ethyl(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one?
The canonical SMILES for 8-[ethyl(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one is CCN(CCO)C1CCCc2ccc(=O)[nH]c21.
What is the InChIKey of 8-[ethyl(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one?
The InChIKey is UTPWZTYSVFBBRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-2-15(8-9-16)11-5-3-4-10-6-7-12(17)14-13(10)11/h6-7,11,16H,2-5,8-9H2,1H3,(H,14,17).
What are the key properties of 8-[ethyl(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one?
8-[ethyl(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one has a molecular weight of 236.31 g/mol, XLogP of 1.07, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[ethyl(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one is sourced from PubChem (CID 13463811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).