quinolin-8-ylmethyl N-(2,4,6-trimethylphenyl)carbamate

C20H20N2O2 — CID 30195361

IUPACquinolin-8-ylmethyl N-(2,4,6-trimethylphenyl)carbamate
SMILESCc1cc(C)c(NC(=O)OCc2cccc3cccnc23)c(C)c1
InChIInChI=1S/C20H20N2O2/c1-13-10-14(2)18(15(3)11-13)22-20(23)24-12-17-7-4-6-16-8-5-9-21-19(16)17/h4-11H,12H2,1-3H3,(H,22,23)
InChIKeyZFMDIUDKVPLOKM-UHFFFAOYSA-N
MW320.39 g/mol
LogP4.91
Rot. Bonds3

About quinolin-8-ylmethyl N-(2,4,6-trimethylphenyl)carbamate

quinolin-8-ylmethyl N-(2,4,6-trimethylphenyl)carbamate (PubChem CID 30195361) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is quinolin-8-ylmethyl N-(2,4,6-trimethylphenyl)carbamate.

Molecular Properties

Compound Namequinolin-8-ylmethyl N-(2,4,6-trimethylphenyl)carbamate
PubChem CID30195361
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC Namequinolin-8-ylmethyl N-(2,4,6-trimethylphenyl)carbamate
SMILESCc1cc(C)c(NC(=O)OCc2cccc3cccnc23)c(C)c1
InChIInChI=1S/C20H20N2O2/c1-13-10-14(2)18(15(3)11-13)22-20(23)24-12-17-7-4-6-16-8-5-9-21-19(16)17/h4-11H,12H2,1-3H3,(H,22,23)
InChIKeyZFMDIUDKVPLOKM-UHFFFAOYSA-N
XLogP4.91
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of quinolin-8-ylmethyl N-(2,4,6-trimethylphenyl)carbamate?
The IUPAC name of quinolin-8-ylmethyl N-(2,4,6-trimethylphenyl)carbamate (CID 30195361) is quinolin-8-ylmethyl N-(2,4,6-trimethylphenyl)carbamate.
What is the SMILES notation for quinolin-8-ylmethyl N-(2,4,6-trimethylphenyl)carbamate?
The canonical SMILES for quinolin-8-ylmethyl N-(2,4,6-trimethylphenyl)carbamate is Cc1cc(C)c(NC(=O)OCc2cccc3cccnc23)c(C)c1.
What is the InChIKey of quinolin-8-ylmethyl N-(2,4,6-trimethylphenyl)carbamate?
The InChIKey is ZFMDIUDKVPLOKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2/c1-13-10-14(2)18(15(3)11-13)22-20(23)24-12-17-7-4-6-16-8-5-9-21-19(16)17/h4-11H,12H2,1-3H3,(H,22,23).
What are the key properties of quinolin-8-ylmethyl N-(2,4,6-trimethylphenyl)carbamate?
quinolin-8-ylmethyl N-(2,4,6-trimethylphenyl)carbamate has a molecular weight of 320.39 g/mol, XLogP of 4.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for quinolin-8-ylmethyl N-(2,4,6-trimethylphenyl)carbamate is sourced from PubChem (CID 30195361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).