N-(2-bromophenyl)-2-(3-methyl-2-oxo-1H-quinolin-6-yl)acetamide

C18H15BrN2O2 — CID 110300601

IUPACN-(2-bromophenyl)-2-(3-methyl-2-oxo-1H-quinolin-6-yl)acetamide
SMILESCc1cc2cc(CC(=O)Nc3ccccc3Br)ccc2[nH]c1=O
InChIInChI=1S/C18H15BrN2O2/c1-11-8-13-9-12(6-7-15(13)21-18(11)23)10-17(22)20-16-5-3-2-4-14(16)19/h2-9H,10H2,1H3,(H,20,22)(H,21,23)
InChIKeyDOFZMDWSYGLFRB-UHFFFAOYSA-N
MW371.23 g/mol
LogP3.78
Rot. Bonds3

About N-(2-bromophenyl)-2-(3-methyl-2-oxo-1H-quinolin-6-yl)acetamide

N-(2-bromophenyl)-2-(3-methyl-2-oxo-1H-quinolin-6-yl)acetamide (PubChem CID 110300601) has the molecular formula C18H15BrN2O2 and a molecular weight of 371.23 g/mol. Its IUPAC name is N-(2-bromophenyl)-2-(3-methyl-2-oxo-1H-quinolin-6-yl)acetamide.

Molecular Properties

Compound NameN-(2-bromophenyl)-2-(3-methyl-2-oxo-1H-quinolin-6-yl)acetamide
PubChem CID110300601
Molecular FormulaC18H15BrN2O2
Molecular Weight371.23 g/mol
Exact Mass370.03
IUPAC NameN-(2-bromophenyl)-2-(3-methyl-2-oxo-1H-quinolin-6-yl)acetamide
SMILESCc1cc2cc(CC(=O)Nc3ccccc3Br)ccc2[nH]c1=O
InChIInChI=1S/C18H15BrN2O2/c1-11-8-13-9-12(6-7-15(13)21-18(11)23)10-17(22)20-16-5-3-2-4-14(16)19/h2-9H,10H2,1H3,(H,20,22)(H,21,23)
InChIKeyDOFZMDWSYGLFRB-UHFFFAOYSA-N
XLogP3.78
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.23
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-(2-methylphenyl)propanamide
CID 110390135
N-(2,3-dimethylphenyl)-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide
CID 110390145
2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 110616680
N-(2-bromophenyl)-2-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide
CID 110774064
N-(2-bromophenyl)-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide
CID 136669960
N-[4-(2-methoxyphenyl)butyl]-2-(3-methyl-2-oxo-1H-quinolin-6-yl)acetamide
CID 110616089
N-(4-fluorophenyl)-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide
CID 110390148
N-(1,3-benzodioxol-5-ylmethyl)-2-(3-methyl-2-oxo-1H-quinolin-6-yl)acetamide
CID 110300545
3-(2-methoxyphenyl)-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]propanamide
CID 110666107
N-(3-fluorophenyl)-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide
CID 110390165
N'-(2-bromophenyl)-N-(2-methylphenyl)propanediamide
CID 108952966
N-cyclopropyl-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide
CID 110390059

Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-2-(3-methyl-2-oxo-1H-quinolin-6-yl)acetamide?
The IUPAC name of N-(2-bromophenyl)-2-(3-methyl-2-oxo-1H-quinolin-6-yl)acetamide (CID 110300601) is N-(2-bromophenyl)-2-(3-methyl-2-oxo-1H-quinolin-6-yl)acetamide.
What is the SMILES notation for N-(2-bromophenyl)-2-(3-methyl-2-oxo-1H-quinolin-6-yl)acetamide?
The canonical SMILES for N-(2-bromophenyl)-2-(3-methyl-2-oxo-1H-quinolin-6-yl)acetamide is Cc1cc2cc(CC(=O)Nc3ccccc3Br)ccc2[nH]c1=O.
What is the InChIKey of N-(2-bromophenyl)-2-(3-methyl-2-oxo-1H-quinolin-6-yl)acetamide?
The InChIKey is DOFZMDWSYGLFRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15BrN2O2/c1-11-8-13-9-12(6-7-15(13)21-18(11)23)10-17(22)20-16-5-3-2-4-14(16)19/h2-9H,10H2,1H3,(H,20,22)(H,21,23).
What are the key properties of N-(2-bromophenyl)-2-(3-methyl-2-oxo-1H-quinolin-6-yl)acetamide?
N-(2-bromophenyl)-2-(3-methyl-2-oxo-1H-quinolin-6-yl)acetamide has a molecular weight of 371.23 g/mol, XLogP of 3.78, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-2-(3-methyl-2-oxo-1H-quinolin-6-yl)acetamide is sourced from PubChem (CID 110300601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).