quinolin-8-yl N-(2-methylphenyl)carbamate

C17H14N2O2 — CID 5181498

IUPACquinolin-8-yl N-(2-methylphenyl)carbamate
SMILESCc1ccccc1NC(=O)Oc1cccc2cccnc12
InChIInChI=1S/C17H14N2O2/c1-12-6-2-3-9-14(12)19-17(20)21-15-10-4-7-13-8-5-11-18-16(13)15/h2-11H,1H3,(H,19,20)
InChIKeyMXJBBKMHCGJHBB-UHFFFAOYSA-N
MW278.31 g/mol
LogP4.15
Rot. Bonds2

About quinolin-8-yl N-(2-methylphenyl)carbamate

quinolin-8-yl N-(2-methylphenyl)carbamate (PubChem CID 5181498) has the molecular formula C17H14N2O2 and a molecular weight of 278.31 g/mol. Its IUPAC name is quinolin-8-yl N-(2-methylphenyl)carbamate.

Molecular Properties

Compound Namequinolin-8-yl N-(2-methylphenyl)carbamate
PubChem CID5181498
Molecular FormulaC17H14N2O2
Molecular Weight278.31 g/mol
Exact Mass278.11
IUPAC Namequinolin-8-yl N-(2-methylphenyl)carbamate
SMILESCc1ccccc1NC(=O)Oc1cccc2cccnc12
InChIInChI=1S/C17H14N2O2/c1-12-6-2-3-9-14(12)19-17(20)21-15-10-4-7-13-8-5-11-18-16(13)15/h2-11H,1H3,(H,19,20)
InChIKeyMXJBBKMHCGJHBB-UHFFFAOYSA-N
XLogP4.15
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 54.15
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-methylphenyl)carbamate?
The IUPAC name of quinolin-8-yl N-(2-methylphenyl)carbamate (CID 5181498) is quinolin-8-yl N-(2-methylphenyl)carbamate.
What is the SMILES notation for quinolin-8-yl N-(2-methylphenyl)carbamate?
The canonical SMILES for quinolin-8-yl N-(2-methylphenyl)carbamate is Cc1ccccc1NC(=O)Oc1cccc2cccnc12.
What is the InChIKey of quinolin-8-yl N-(2-methylphenyl)carbamate?
The InChIKey is MXJBBKMHCGJHBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O2/c1-12-6-2-3-9-14(12)19-17(20)21-15-10-4-7-13-8-5-11-18-16(13)15/h2-11H,1H3,(H,19,20).
What are the key properties of quinolin-8-yl N-(2-methylphenyl)carbamate?
quinolin-8-yl N-(2-methylphenyl)carbamate has a molecular weight of 278.31 g/mol, XLogP of 4.15, 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-methylphenyl)carbamate is sourced from PubChem (CID 5181498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).