phenyl N-(2,6-dimethylquinolin-3-yl)carbamate

C18H16N2O2 — CID 155691129

IUPACphenyl N-(2,6-dimethylquinolin-3-yl)carbamate
SMILESCc1ccc2nc(C)c(NC(=O)Oc3ccccc3)cc2c1
InChIInChI=1S/C18H16N2O2/c1-12-8-9-16-14(10-12)11-17(13(2)19-16)20-18(21)22-15-6-4-3-5-7-15/h3-11H,1-2H3,(H,20,21)
InChIKeyXBKKJGZSJMMVGA-UHFFFAOYSA-N
MW292.34 g/mol
LogP4.46
Rot. Bonds2

About phenyl N-(2,6-dimethylquinolin-3-yl)carbamate

phenyl N-(2,6-dimethylquinolin-3-yl)carbamate (PubChem CID 155691129) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is phenyl N-(2,6-dimethylquinolin-3-yl)carbamate.

Molecular Properties

Compound Namephenyl N-(2,6-dimethylquinolin-3-yl)carbamate
PubChem CID155691129
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Namephenyl N-(2,6-dimethylquinolin-3-yl)carbamate
SMILESCc1ccc2nc(C)c(NC(=O)Oc3ccccc3)cc2c1
InChIInChI=1S/C18H16N2O2/c1-12-8-9-16-14(10-12)11-17(13(2)19-16)20-18(21)22-15-6-4-3-5-7-15/h3-11H,1-2H3,(H,20,21)
InChIKeyXBKKJGZSJMMVGA-UHFFFAOYSA-N
XLogP4.46
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

phenyl N-(2-bromo-4-methylphenyl)carbamate
CID 3453949
2,6-dimethyl-N-(2-methylphenyl)quinoline-3-carboxamide
CID 51283578
phenyl N-(5-acetyl-2-methoxy-6-methyl-3-pyridinyl)carbamate
CID 19357047
4-methyl-5-(phenoxycarbonylamino)phthalic acid
CID 67543732
phenyl N-(2-ethoxy-5-ethyl-6-methyl-3-pyridinyl)carbamate
CID 18663163
phenyl N-(4-methyl-2-propoxyphenyl)carbamate
CID 61216988
2-methyl-6-(phenoxycarbonylamino)pyridine-3-carboxylic acid
CID 90422775
phenyl N-(2-tert-butyl-6-methyl-4-pyridinyl)carbamate
CID 169322759
methyl 4-[3-methyl-5-[(4-methylphenoxy)carbonylamino]-6-phenyl-2-pyridinyl]pyridine-2-carboxylate
CID 137423025
phenyl N-(5-methyl-1,2-oxazol-3-yl)carbamate
CID 4519264
N-(4-methoxyphenyl)-2,6-dimethylquinoline-3-carboxamide
CID 34742642
phenyl 2,6-dimethylquinoline-4-carboxylate
CID 18076219

Frequently Asked Questions

What is the IUPAC name of phenyl N-(2,6-dimethylquinolin-3-yl)carbamate?
The IUPAC name of phenyl N-(2,6-dimethylquinolin-3-yl)carbamate (CID 155691129) is phenyl N-(2,6-dimethylquinolin-3-yl)carbamate.
What is the SMILES notation for phenyl N-(2,6-dimethylquinolin-3-yl)carbamate?
The canonical SMILES for phenyl N-(2,6-dimethylquinolin-3-yl)carbamate is Cc1ccc2nc(C)c(NC(=O)Oc3ccccc3)cc2c1.
What is the InChIKey of phenyl N-(2,6-dimethylquinolin-3-yl)carbamate?
The InChIKey is XBKKJGZSJMMVGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-12-8-9-16-14(10-12)11-17(13(2)19-16)20-18(21)22-15-6-4-3-5-7-15/h3-11H,1-2H3,(H,20,21).
What are the key properties of phenyl N-(2,6-dimethylquinolin-3-yl)carbamate?
phenyl N-(2,6-dimethylquinolin-3-yl)carbamate has a molecular weight of 292.34 g/mol, XLogP of 4.46, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl N-(2,6-dimethylquinolin-3-yl)carbamate is sourced from PubChem (CID 155691129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).