quinolin-7-yl N,N-dimethylcarbamate

C12H12N2O2 — CID 11218314

IUPACquinolin-7-yl N,N-dimethylcarbamate
SMILESCN(C)C(=O)Oc1ccc2cccnc2c1
InChIInChI=1S/C12H12N2O2/c1-14(2)12(15)16-10-6-5-9-4-3-7-13-11(9)8-10/h3-8H,1-2H3
InChIKeyIOGBSPBEMWFBFB-UHFFFAOYSA-N
MW216.24 g/mol
LogP2.30
Rot. Bonds1

About quinolin-7-yl N,N-dimethylcarbamate

quinolin-7-yl N,N-dimethylcarbamate (PubChem CID 11218314) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is quinolin-7-yl N,N-dimethylcarbamate.

Molecular Properties

Compound Namequinolin-7-yl N,N-dimethylcarbamate
PubChem CID11218314
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Namequinolin-7-yl N,N-dimethylcarbamate
SMILESCN(C)C(=O)Oc1ccc2cccnc2c1
InChIInChI=1S/C12H12N2O2/c1-14(2)12(15)16-10-6-5-9-4-3-7-13-11(9)8-10/h3-8H,1-2H3
InChIKeyIOGBSPBEMWFBFB-UHFFFAOYSA-N
XLogP2.30
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of quinolin-7-yl N,N-dimethylcarbamate?
The IUPAC name of quinolin-7-yl N,N-dimethylcarbamate (CID 11218314) is quinolin-7-yl N,N-dimethylcarbamate.
What is the SMILES notation for quinolin-7-yl N,N-dimethylcarbamate?
The canonical SMILES for quinolin-7-yl N,N-dimethylcarbamate is CN(C)C(=O)Oc1ccc2cccnc2c1.
What is the InChIKey of quinolin-7-yl N,N-dimethylcarbamate?
The InChIKey is IOGBSPBEMWFBFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c1-14(2)12(15)16-10-6-5-9-4-3-7-13-11(9)8-10/h3-8H,1-2H3.
What are the key properties of quinolin-7-yl N,N-dimethylcarbamate?
quinolin-7-yl N,N-dimethylcarbamate has a molecular weight of 216.24 g/mol, XLogP of 2.30, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for quinolin-7-yl N,N-dimethylcarbamate is sourced from PubChem (CID 11218314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).