N,N-dibutyl-2-(4-hydroxy-2-oxo-1H-quinolin-3-yl)acetamide

C19H26N2O3 — CID 54706987

IUPACN,N-dibutyl-2-(4-hydroxy-2-oxo-1H-quinolin-3-yl)acetamide
SMILESCCCCN(CCCC)C(=O)Cc1c(O)c2ccccc2[nH]c1=O
InChIInChI=1S/C19H26N2O3/c1-3-5-11-21(12-6-4-2)17(22)13-15-18(23)14-9-7-8-10-16(14)20-19(15)24/h7-10H,3-6,11-13H2,1-2H3,(H2,20,23,24)
InChIKeyAGVBZCMGJUMHPH-UHFFFAOYSA-N
MW330.43 g/mol
LogP3.20
Rot. Bonds8

About N,N-dibutyl-2-(4-hydroxy-2-oxo-1H-quinolin-3-yl)acetamide

N,N-dibutyl-2-(4-hydroxy-2-oxo-1H-quinolin-3-yl)acetamide (PubChem CID 54706987) has the molecular formula C19H26N2O3 and a molecular weight of 330.43 g/mol. Its IUPAC name is N,N-dibutyl-2-(4-hydroxy-2-oxo-1H-quinolin-3-yl)acetamide.

Molecular Properties

Compound NameN,N-dibutyl-2-(4-hydroxy-2-oxo-1H-quinolin-3-yl)acetamide
PubChem CID54706987
Molecular FormulaC19H26N2O3
Molecular Weight330.43 g/mol
Exact Mass330.19
IUPAC NameN,N-dibutyl-2-(4-hydroxy-2-oxo-1H-quinolin-3-yl)acetamide
SMILESCCCCN(CCCC)C(=O)Cc1c(O)c2ccccc2[nH]c1=O
InChIInChI=1S/C19H26N2O3/c1-3-5-11-21(12-6-4-2)17(22)13-15-18(23)14-9-7-8-10-16(14)20-19(15)24/h7-10H,3-6,11-13H2,1-2H3,(H2,20,23,24)
InChIKeyAGVBZCMGJUMHPH-UHFFFAOYSA-N
XLogP3.20
TPSA73.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dibutyl-2-(4-hydroxy-2-oxo-1H-quinolin-3-yl)acetamide?
The IUPAC name of N,N-dibutyl-2-(4-hydroxy-2-oxo-1H-quinolin-3-yl)acetamide (CID 54706987) is N,N-dibutyl-2-(4-hydroxy-2-oxo-1H-quinolin-3-yl)acetamide.
What is the SMILES notation for N,N-dibutyl-2-(4-hydroxy-2-oxo-1H-quinolin-3-yl)acetamide?
The canonical SMILES for N,N-dibutyl-2-(4-hydroxy-2-oxo-1H-quinolin-3-yl)acetamide is CCCCN(CCCC)C(=O)Cc1c(O)c2ccccc2[nH]c1=O.
What is the InChIKey of N,N-dibutyl-2-(4-hydroxy-2-oxo-1H-quinolin-3-yl)acetamide?
The InChIKey is AGVBZCMGJUMHPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O3/c1-3-5-11-21(12-6-4-2)17(22)13-15-18(23)14-9-7-8-10-16(14)20-19(15)24/h7-10H,3-6,11-13H2,1-2H3,(H2,20,23,24).
What are the key properties of N,N-dibutyl-2-(4-hydroxy-2-oxo-1H-quinolin-3-yl)acetamide?
N,N-dibutyl-2-(4-hydroxy-2-oxo-1H-quinolin-3-yl)acetamide has a molecular weight of 330.43 g/mol, XLogP of 3.20, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutyl-2-(4-hydroxy-2-oxo-1H-quinolin-3-yl)acetamide is sourced from PubChem (CID 54706987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).