N,N-dimethyl-4-oxo-1H-quinoline-2-carboxamide

C12H12N2O2 — CID 47120436

IUPACN,N-dimethyl-4-oxo-1H-quinoline-2-carboxamide
SMILESCN(C)C(=O)c1cc(=O)c2ccccc2[nH]1
InChIInChI=1S/C12H12N2O2/c1-14(2)12(16)10-7-11(15)8-5-3-4-6-9(8)13-10/h3-7H,1-2H3,(H,13,15)
InChIKeyYESAATYHJNXGHD-UHFFFAOYSA-N
MW216.24 g/mol
LogP1.23
Rot. Bonds1

About N,N-dimethyl-4-oxo-1H-quinoline-2-carboxamide

N,N-dimethyl-4-oxo-1H-quinoline-2-carboxamide (PubChem CID 47120436) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is N,N-dimethyl-4-oxo-1H-quinoline-2-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-4-oxo-1H-quinoline-2-carboxamide
PubChem CID47120436
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC NameN,N-dimethyl-4-oxo-1H-quinoline-2-carboxamide
SMILESCN(C)C(=O)c1cc(=O)c2ccccc2[nH]1
InChIInChI=1S/C12H12N2O2/c1-14(2)12(16)10-7-11(15)8-5-3-4-6-9(8)13-10/h3-7H,1-2H3,(H,13,15)
InChIKeyYESAATYHJNXGHD-UHFFFAOYSA-N
XLogP1.23
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[methyl-(4-oxo-1H-quinoline-2-carbonyl)amino]propanoic acid
CID 62625856
3-[methyl-(4-oxo-1H-quinoline-2-carbonyl)amino]propanoic acid
CID 60989084
N-ethyl-4-oxo-1H-quinoline-2-carboxamide
CID 47115379
acetamide;4-oxo-1H-quinoline-2-carboxylic acid
CID 160920347
4-bromo-N,N-dimethyl-1H-indole-2-carboxamide
CID 66897930
4-ethyl-N,N-dimethyl-1H-indole-2-carboxamide
CID 176933500
N,N-dimethyl-1-oxo-2H-isoquinoline-3-carboxamide
CID 47120487
N-(2-hydroxyethyl)-4-oxo-N-prop-2-enyl-1H-quinoline-2-carboxamide
CID 115776313
4-oxo-1H-quinoline-2-carbonyl isocyanate
CID 19004891
(2R)-2-[(4-oxo-1H-quinoline-2-carbonyl)amino]propanoic acid
CID 54991567
4-oxo-N-[(2,4,6-trimethylphenyl)methyl]-1H-quinoline-2-carboxamide
CID 51091615
2-(piperidine-1-carbonyl)-1H-quinolin-4-one
CID 47120448

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-oxo-1H-quinoline-2-carboxamide?
The IUPAC name of N,N-dimethyl-4-oxo-1H-quinoline-2-carboxamide (CID 47120436) is N,N-dimethyl-4-oxo-1H-quinoline-2-carboxamide.
What is the SMILES notation for N,N-dimethyl-4-oxo-1H-quinoline-2-carboxamide?
The canonical SMILES for N,N-dimethyl-4-oxo-1H-quinoline-2-carboxamide is CN(C)C(=O)c1cc(=O)c2ccccc2[nH]1.
What is the InChIKey of N,N-dimethyl-4-oxo-1H-quinoline-2-carboxamide?
The InChIKey is YESAATYHJNXGHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c1-14(2)12(16)10-7-11(15)8-5-3-4-6-9(8)13-10/h3-7H,1-2H3,(H,13,15).
What are the key properties of N,N-dimethyl-4-oxo-1H-quinoline-2-carboxamide?
N,N-dimethyl-4-oxo-1H-quinoline-2-carboxamide has a molecular weight of 216.24 g/mol, XLogP of 1.23, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-oxo-1H-quinoline-2-carboxamide is sourced from PubChem (CID 47120436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).