quinolin-8-yl N-(2,4-dimethylphenyl)carbamate

C18H16N2O2 — CID 3307290

IUPACquinolin-8-yl N-(2,4-dimethylphenyl)carbamate
SMILESCc1ccc(NC(=O)Oc2cccc3cccnc23)c(C)c1
InChIInChI=1S/C18H16N2O2/c1-12-8-9-15(13(2)11-12)20-18(21)22-16-7-3-5-14-6-4-10-19-17(14)16/h3-11H,1-2H3,(H,20,21)
InChIKeyQTZVNXPEIUZEQZ-UHFFFAOYSA-N
MW292.34 g/mol
LogP4.46
Rot. Bonds2

About quinolin-8-yl N-(2,4-dimethylphenyl)carbamate

quinolin-8-yl N-(2,4-dimethylphenyl)carbamate (PubChem CID 3307290) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is quinolin-8-yl N-(2,4-dimethylphenyl)carbamate.

Molecular Properties

Compound Namequinolin-8-yl N-(2,4-dimethylphenyl)carbamate
PubChem CID3307290
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Namequinolin-8-yl N-(2,4-dimethylphenyl)carbamate
SMILESCc1ccc(NC(=O)Oc2cccc3cccnc23)c(C)c1
InChIInChI=1S/C18H16N2O2/c1-12-8-9-15(13(2)11-12)20-18(21)22-16-7-3-5-14-6-4-10-19-17(14)16/h3-11H,1-2H3,(H,20,21)
InChIKeyQTZVNXPEIUZEQZ-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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Frequently Asked Questions

What is the IUPAC name of quinolin-8-yl N-(2,4-dimethylphenyl)carbamate?
The IUPAC name of quinolin-8-yl N-(2,4-dimethylphenyl)carbamate (CID 3307290) is quinolin-8-yl N-(2,4-dimethylphenyl)carbamate.
What is the SMILES notation for quinolin-8-yl N-(2,4-dimethylphenyl)carbamate?
The canonical SMILES for quinolin-8-yl N-(2,4-dimethylphenyl)carbamate is Cc1ccc(NC(=O)Oc2cccc3cccnc23)c(C)c1.
What is the InChIKey of quinolin-8-yl N-(2,4-dimethylphenyl)carbamate?
The InChIKey is QTZVNXPEIUZEQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-12-8-9-15(13(2)11-12)20-18(21)22-16-7-3-5-14-6-4-10-19-17(14)16/h3-11H,1-2H3,(H,20,21).
What are the key properties of quinolin-8-yl N-(2,4-dimethylphenyl)carbamate?
quinolin-8-yl N-(2,4-dimethylphenyl)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 quinolin-8-yl N-(2,4-dimethylphenyl)carbamate is sourced from PubChem (CID 3307290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).