4-cyclopropyl-1-ethyl-6-methylquinolin-2-one;ethane

C17H23NO — CID 145235316

IUPAC4-cyclopropyl-1-ethyl-6-methylquinolin-2-one;ethane
SMILESCC.CCn1c(=O)cc(C2CC2)c2cc(C)ccc21
InChIInChI=1S/C15H17NO.C2H6/c1-3-16-14-7-4-10(2)8-13(14)12(9-15(16)17)11-5-6-11;1-2/h4,7-9,11H,3,5-6H2,1-2H3;1-2H3
InChIKeySLXLITSDKARYBH-UHFFFAOYSA-N
MW257.38 g/mol
LogP4.23
Rot. Bonds2

About 4-cyclopropyl-1-ethyl-6-methylquinolin-2-one;ethane

4-cyclopropyl-1-ethyl-6-methylquinolin-2-one;ethane (PubChem CID 145235316) has the molecular formula C17H23NO and a molecular weight of 257.38 g/mol. Its IUPAC name is 4-cyclopropyl-1-ethyl-6-methylquinolin-2-one;ethane.

Molecular Properties

Compound Name4-cyclopropyl-1-ethyl-6-methylquinolin-2-one;ethane
PubChem CID145235316
Molecular FormulaC17H23NO
Molecular Weight257.38 g/mol
Exact Mass257.18
IUPAC Name4-cyclopropyl-1-ethyl-6-methylquinolin-2-one;ethane
SMILESCC.CCn1c(=O)cc(C2CC2)c2cc(C)ccc21
InChIInChI=1S/C15H17NO.C2H6/c1-3-16-14-7-4-10(2)8-13(14)12(9-15(16)17)11-5-6-11;1-2/h4,7-9,11H,3,5-6H2,1-2H3;1-2H3
InChIKeySLXLITSDKARYBH-UHFFFAOYSA-N
XLogP4.23
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-1-ethyl-6-methylquinolin-2-one;ethane?
The IUPAC name of 4-cyclopropyl-1-ethyl-6-methylquinolin-2-one;ethane (CID 145235316) is 4-cyclopropyl-1-ethyl-6-methylquinolin-2-one;ethane.
What is the SMILES notation for 4-cyclopropyl-1-ethyl-6-methylquinolin-2-one;ethane?
The canonical SMILES for 4-cyclopropyl-1-ethyl-6-methylquinolin-2-one;ethane is CC.CCn1c(=O)cc(C2CC2)c2cc(C)ccc21.
What is the InChIKey of 4-cyclopropyl-1-ethyl-6-methylquinolin-2-one;ethane?
The InChIKey is SLXLITSDKARYBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO.C2H6/c1-3-16-14-7-4-10(2)8-13(14)12(9-15(16)17)11-5-6-11;1-2/h4,7-9,11H,3,5-6H2,1-2H3;1-2H3.
What are the key properties of 4-cyclopropyl-1-ethyl-6-methylquinolin-2-one;ethane?
4-cyclopropyl-1-ethyl-6-methylquinolin-2-one;ethane has a molecular weight of 257.38 g/mol, XLogP of 4.23, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-1-ethyl-6-methylquinolin-2-one;ethane is sourced from PubChem (CID 145235316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).