methyl N-(5-methoxyquinolin-8-yl)-N-methylcarbamate

C13H14N2O3 — CID 139305519

IUPACmethyl N-(5-methoxyquinolin-8-yl)-N-methylcarbamate
SMILESCOC(=O)N(C)c1ccc(OC)c2cccnc12
InChIInChI=1S/C13H14N2O3/c1-15(13(16)18-3)10-6-7-11(17-2)9-5-4-8-14-12(9)10/h4-8H,1-3H3
InChIKeyQZQCSGDFHWQBBI-UHFFFAOYSA-N
MW246.27 g/mol
LogP2.45
Rot. Bonds2

About methyl N-(5-methoxyquinolin-8-yl)-N-methylcarbamate

methyl N-(5-methoxyquinolin-8-yl)-N-methylcarbamate (PubChem CID 139305519) has the molecular formula C13H14N2O3 and a molecular weight of 246.27 g/mol. Its IUPAC name is methyl N-(5-methoxyquinolin-8-yl)-N-methylcarbamate.

Molecular Properties

Compound Namemethyl N-(5-methoxyquinolin-8-yl)-N-methylcarbamate
PubChem CID139305519
Molecular FormulaC13H14N2O3
Molecular Weight246.27 g/mol
Exact Mass246.10
IUPAC Namemethyl N-(5-methoxyquinolin-8-yl)-N-methylcarbamate
SMILESCOC(=O)N(C)c1ccc(OC)c2cccnc12
InChIInChI=1S/C13H14N2O3/c1-15(13(16)18-3)10-6-7-11(17-2)9-5-4-8-14-12(9)10/h4-8H,1-3H3
InChIKeyQZQCSGDFHWQBBI-UHFFFAOYSA-N
XLogP2.45
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

8-methoxy-N,N-dimethylquinolin-5-amine
CID 67991214
propan-2-yl 5-methoxyquinoline-8-carboxylate
CID 67977903
CID 88936748
CID 88936748
8-(chloromethyl)-5-methoxyquinoline
CID 66754973
N-(5-methoxyquinolin-8-yl)formamide
CID 886460
[8-[[5-(dimethylcarbamoyloxy)quinolin-8-yl]methyl]quinolin-5-yl] N,N-dimethylcarbamate
CID 140575764
methyl 5-(5-methoxyquinolin-8-yl)furan-2-carboxylate
CID 53469334
methyl 3-(8-methoxyquinolin-5-yl)-2-methyl-3-oxopropanoate
CID 59335917
5-methoxy-1,7-phenanthroline
CID 67576947
N-(8-methoxyquinolin-5-yl)-3-methylbutanamide
CID 26823099
2-ethyl-N-(8-methoxyquinolin-5-yl)butanamide
CID 26823136
(4-methoxyquinolin-8-yl)carbamic acid
CID 155211747

Frequently Asked Questions

What is the IUPAC name of methyl N-(5-methoxyquinolin-8-yl)-N-methylcarbamate?
The IUPAC name of methyl N-(5-methoxyquinolin-8-yl)-N-methylcarbamate (CID 139305519) is methyl N-(5-methoxyquinolin-8-yl)-N-methylcarbamate.
What is the SMILES notation for methyl N-(5-methoxyquinolin-8-yl)-N-methylcarbamate?
The canonical SMILES for methyl N-(5-methoxyquinolin-8-yl)-N-methylcarbamate is COC(=O)N(C)c1ccc(OC)c2cccnc12.
What is the InChIKey of methyl N-(5-methoxyquinolin-8-yl)-N-methylcarbamate?
The InChIKey is QZQCSGDFHWQBBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3/c1-15(13(16)18-3)10-6-7-11(17-2)9-5-4-8-14-12(9)10/h4-8H,1-3H3.
What are the key properties of methyl N-(5-methoxyquinolin-8-yl)-N-methylcarbamate?
methyl N-(5-methoxyquinolin-8-yl)-N-methylcarbamate has a molecular weight of 246.27 g/mol, XLogP of 2.45, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-(5-methoxyquinolin-8-yl)-N-methylcarbamate is sourced from PubChem (CID 139305519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).