N-(2-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide

C16H24N2O2 — CID 107313939

IUPACN-(2-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide
SMILESCCC(C)(C)NC(=O)COc1ccc2c(c1)NCCC2
InChIInChI=1S/C16H24N2O2/c1-4-16(2,3)18-15(19)11-20-13-8-7-12-6-5-9-17-14(12)10-13/h7-8,10,17H,4-6,9,11H2,1-3H3,(H,18,19)
InChIKeyBZRVKGOXLCDHBY-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.73
Rot. Bonds5

About N-(2-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide

N-(2-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide (PubChem CID 107313939) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(2-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide.

Molecular Properties

Compound NameN-(2-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide
PubChem CID107313939
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(2-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide
SMILESCCC(C)(C)NC(=O)COc1ccc2c(c1)NCCC2
InChIInChI=1S/C16H24N2O2/c1-4-16(2,3)18-15(19)11-20-13-8-7-12-6-5-9-17-14(12)10-13/h7-8,10,17H,4-6,9,11H2,1-3H3,(H,18,19)
InChIKeyBZRVKGOXLCDHBY-UHFFFAOYSA-N
XLogP2.73
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide?
The IUPAC name of N-(2-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide (CID 107313939) is N-(2-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide.
What is the SMILES notation for N-(2-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide?
The canonical SMILES for N-(2-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide is CCC(C)(C)NC(=O)COc1ccc2c(c1)NCCC2.
What is the InChIKey of N-(2-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide?
The InChIKey is BZRVKGOXLCDHBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-4-16(2,3)18-15(19)11-20-13-8-7-12-6-5-9-17-14(12)10-13/h7-8,10,17H,4-6,9,11H2,1-3H3,(H,18,19).
What are the key properties of N-(2-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide?
N-(2-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide has a molecular weight of 276.38 g/mol, XLogP of 2.73, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide is sourced from PubChem (CID 107313939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).