N-(5-bromoquinolin-8-yl)-2-(oxolan-3-yl)acetamide

C15H15BrN2O2 — CID 119051811

IUPACN-(5-bromoquinolin-8-yl)-2-(oxolan-3-yl)acetamide
SMILESO=C(CC1CCOC1)Nc1ccc(Br)c2cccnc12
InChIInChI=1S/C15H15BrN2O2/c16-12-3-4-13(15-11(12)2-1-6-17-15)18-14(19)8-10-5-7-20-9-10/h1-4,6,10H,5,7-9H2,(H,18,19)
InChIKeyIMPAQEUEFOZDHD-UHFFFAOYSA-N
MW335.20 g/mol
LogP3.36
Rot. Bonds3

About N-(5-bromoquinolin-8-yl)-2-(oxolan-3-yl)acetamide

N-(5-bromoquinolin-8-yl)-2-(oxolan-3-yl)acetamide (PubChem CID 119051811) has the molecular formula C15H15BrN2O2 and a molecular weight of 335.20 g/mol. Its IUPAC name is N-(5-bromoquinolin-8-yl)-2-(oxolan-3-yl)acetamide.

Molecular Properties

Compound NameN-(5-bromoquinolin-8-yl)-2-(oxolan-3-yl)acetamide
PubChem CID119051811
Molecular FormulaC15H15BrN2O2
Molecular Weight335.20 g/mol
Exact Mass334.03
IUPAC NameN-(5-bromoquinolin-8-yl)-2-(oxolan-3-yl)acetamide
SMILESO=C(CC1CCOC1)Nc1ccc(Br)c2cccnc12
InChIInChI=1S/C15H15BrN2O2/c16-12-3-4-13(15-11(12)2-1-6-17-15)18-14(19)8-10-5-7-20-9-10/h1-4,6,10H,5,7-9H2,(H,18,19)
InChIKeyIMPAQEUEFOZDHD-UHFFFAOYSA-N
XLogP3.36
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.20
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-bromoquinolin-8-yl)butanamide
CID 35287139
(2R)-N-(5-bromoquinolin-8-yl)oxolane-2-carboxamide
CID 35287150
2-[(5-bromoquinolin-8-yl)amino]-2-oxoacetic acid
CID 22742503
2-[2-[(5-bromoquinolin-8-yl)amino]-2-oxoethyl]benzoic acid
CID 56761360
N-(5-bromoquinolin-8-yl)-2-(1H-indol-3-yl)acetamide
CID 35286701
N-[(5-bromoquinolin-8-yl)methyl]oxan-4-amine
CID 112617700
2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(5-bromoquinolin-8-yl)acetamide
CID 19519644
N-(2-bromophenyl)-2-[2-(oxolan-3-yl)ethylamino]acetamide
CID 102672827
N-(5-bromoquinolin-8-yl)-2,6-dichlorobenzamide
CID 35286890
2-cyclopentyl-N-[5-(4-methylphenyl)sulfanylquinolin-8-yl]acetamide
CID 141418898
phenacyl 4-[(5-bromoquinolin-8-yl)amino]-4-oxobutanoate
CID 126189419
2-(azetidin-3-yl)-N-(8-chloroquinolin-5-yl)acetamide
CID 64617391

Frequently Asked Questions

What is the IUPAC name of N-(5-bromoquinolin-8-yl)-2-(oxolan-3-yl)acetamide?
The IUPAC name of N-(5-bromoquinolin-8-yl)-2-(oxolan-3-yl)acetamide (CID 119051811) is N-(5-bromoquinolin-8-yl)-2-(oxolan-3-yl)acetamide.
What is the SMILES notation for N-(5-bromoquinolin-8-yl)-2-(oxolan-3-yl)acetamide?
The canonical SMILES for N-(5-bromoquinolin-8-yl)-2-(oxolan-3-yl)acetamide is O=C(CC1CCOC1)Nc1ccc(Br)c2cccnc12.
What is the InChIKey of N-(5-bromoquinolin-8-yl)-2-(oxolan-3-yl)acetamide?
The InChIKey is IMPAQEUEFOZDHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2O2/c16-12-3-4-13(15-11(12)2-1-6-17-15)18-14(19)8-10-5-7-20-9-10/h1-4,6,10H,5,7-9H2,(H,18,19).
What are the key properties of N-(5-bromoquinolin-8-yl)-2-(oxolan-3-yl)acetamide?
N-(5-bromoquinolin-8-yl)-2-(oxolan-3-yl)acetamide has a molecular weight of 335.20 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromoquinolin-8-yl)-2-(oxolan-3-yl)acetamide is sourced from PubChem (CID 119051811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).