N-(1-hydroxy-3-methylpentan-3-yl)-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide

C17H24N2O3 — CID 110002443

IUPACN-(1-hydroxy-3-methylpentan-3-yl)-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide
SMILESCCC(C)(CCO)NC(=O)CN1C(=O)CCc2ccccc21
InChIInChI=1S/C17H24N2O3/c1-3-17(2,10-11-20)18-15(21)12-19-14-7-5-4-6-13(14)8-9-16(19)22/h4-7,20H,3,8-12H2,1-2H3,(H,18,21)
InChIKeyJVTYJLQMKVBYCG-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.63
Rot. Bonds6

About N-(1-hydroxy-3-methylpentan-3-yl)-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide

N-(1-hydroxy-3-methylpentan-3-yl)-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide (PubChem CID 110002443) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-(1-hydroxy-3-methylpentan-3-yl)-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide.

Molecular Properties

Compound NameN-(1-hydroxy-3-methylpentan-3-yl)-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide
PubChem CID110002443
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC NameN-(1-hydroxy-3-methylpentan-3-yl)-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide
SMILESCCC(C)(CCO)NC(=O)CN1C(=O)CCc2ccccc21
InChIInChI=1S/C17H24N2O3/c1-3-17(2,10-11-20)18-15(21)12-19-14-7-5-4-6-13(14)8-9-16(19)22/h4-7,20H,3,8-12H2,1-2H3,(H,18,21)
InChIKeyJVTYJLQMKVBYCG-UHFFFAOYSA-N
XLogP1.63
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-3-methylpentan-3-yl)-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide?
The IUPAC name of N-(1-hydroxy-3-methylpentan-3-yl)-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide (CID 110002443) is N-(1-hydroxy-3-methylpentan-3-yl)-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide.
What is the SMILES notation for N-(1-hydroxy-3-methylpentan-3-yl)-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide?
The canonical SMILES for N-(1-hydroxy-3-methylpentan-3-yl)-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide is CCC(C)(CCO)NC(=O)CN1C(=O)CCc2ccccc21.
What is the InChIKey of N-(1-hydroxy-3-methylpentan-3-yl)-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide?
The InChIKey is JVTYJLQMKVBYCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-3-17(2,10-11-20)18-15(21)12-19-14-7-5-4-6-13(14)8-9-16(19)22/h4-7,20H,3,8-12H2,1-2H3,(H,18,21).
What are the key properties of N-(1-hydroxy-3-methylpentan-3-yl)-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide?
N-(1-hydroxy-3-methylpentan-3-yl)-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide has a molecular weight of 304.39 g/mol, XLogP of 1.63, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-3-methylpentan-3-yl)-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide is sourced from PubChem (CID 110002443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).