methyl N-methyl-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)carbamate

C12H14N2O3 — CID 115190470

IUPACmethyl N-methyl-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)carbamate
SMILESCOC(=O)N(C)c1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C12H14N2O3/c1-14(12(16)17-2)9-4-5-10-8(7-9)3-6-11(15)13-10/h4-5,7H,3,6H2,1-2H3,(H,13,15)
InChIKeyACCSLJDZNMPEBJ-UHFFFAOYSA-N
MW234.25 g/mol
LogP1.77
Rot. Bonds1

About methyl N-methyl-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)carbamate

methyl N-methyl-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)carbamate (PubChem CID 115190470) has the molecular formula C12H14N2O3 and a molecular weight of 234.25 g/mol. Its IUPAC name is methyl N-methyl-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)carbamate.

Molecular Properties

Compound Namemethyl N-methyl-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)carbamate
PubChem CID115190470
Molecular FormulaC12H14N2O3
Molecular Weight234.25 g/mol
Exact Mass234.10
IUPAC Namemethyl N-methyl-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)carbamate
SMILESCOC(=O)N(C)c1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C12H14N2O3/c1-14(12(16)17-2)9-4-5-10-8(7-9)3-6-11(15)13-10/h4-5,7H,3,6H2,1-2H3,(H,13,15)
InChIKeyACCSLJDZNMPEBJ-UHFFFAOYSA-N
XLogP1.77
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.25
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 3-[methyl-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]propanoate
CID 115232296
3-amino-N-methyl-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)propanamide
CID 82498531
methyl 2-oxo-3,4-dihydro-1H-quinoline-6-carboxylate
CID 9451992
ethyl 2-[methyl-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]acetate
CID 115257291
4-[methyl-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]butanoic acid
CID 115218529
6-(3-amino-N-methylanilino)-3,4-dihydro-1H-quinolin-2-one
CID 117040900
6-[4-(dimethylamino)phenyl]-3,4-dihydro-1H-quinolin-2-one
CID 12001471
6-[2-aminoethyl(methyl)amino]-3,4-dihydro-1H-quinolin-2-one
CID 82493883
methyl 2,3-dihydroxy-3-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)propanoate
CID 171864842
6-[(1-amino-3-methylbutan-2-yl)-methylamino]-3,4-dihydro-1H-quinolin-2-one
CID 115138025
2-[methyl-(2-oxo-1,3-dihydroindol-5-yl)amino]-2-oxoacetic acid
CID 115141221
methyl 2-amino-4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]butanoate
CID 63039322

Frequently Asked Questions

What is the IUPAC name of methyl N-methyl-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)carbamate?
The IUPAC name of methyl N-methyl-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)carbamate (CID 115190470) is methyl N-methyl-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)carbamate.
What is the SMILES notation for methyl N-methyl-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)carbamate?
The canonical SMILES for methyl N-methyl-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)carbamate is COC(=O)N(C)c1ccc2c(c1)CCC(=O)N2.
What is the InChIKey of methyl N-methyl-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)carbamate?
The InChIKey is ACCSLJDZNMPEBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O3/c1-14(12(16)17-2)9-4-5-10-8(7-9)3-6-11(15)13-10/h4-5,7H,3,6H2,1-2H3,(H,13,15).
What are the key properties of methyl N-methyl-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)carbamate?
methyl N-methyl-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)carbamate has a molecular weight of 234.25 g/mol, XLogP of 1.77, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-methyl-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)carbamate is sourced from PubChem (CID 115190470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).