quinolin-8-yl N-propan-2-ylcarbamate

C13H14N2O2 — CID 5146618

IUPACquinolin-8-yl N-propan-2-ylcarbamate
SMILESCC(C)NC(=O)Oc1cccc2cccnc12
InChIInChI=1S/C13H14N2O2/c1-9(2)15-13(16)17-11-7-3-5-10-6-4-8-14-12(10)11/h3-9H,1-2H3,(H,15,16)
InChIKeyMYZZZDHUCNJZNM-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.73
Rot. Bonds2

About quinolin-8-yl N-propan-2-ylcarbamate

quinolin-8-yl N-propan-2-ylcarbamate (PubChem CID 5146618) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is quinolin-8-yl N-propan-2-ylcarbamate.

Molecular Properties

Compound Namequinolin-8-yl N-propan-2-ylcarbamate
PubChem CID5146618
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Namequinolin-8-yl N-propan-2-ylcarbamate
SMILESCC(C)NC(=O)Oc1cccc2cccnc12
InChIInChI=1S/C13H14N2O2/c1-9(2)15-13(16)17-11-7-3-5-10-6-4-8-14-12(10)11/h3-9H,1-2H3,(H,15,16)
InChIKeyMYZZZDHUCNJZNM-UHFFFAOYSA-N
XLogP2.73
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.73
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-propan-2-ylcarbamate?
The IUPAC name of quinolin-8-yl N-propan-2-ylcarbamate (CID 5146618) is quinolin-8-yl N-propan-2-ylcarbamate.
What is the SMILES notation for quinolin-8-yl N-propan-2-ylcarbamate?
The canonical SMILES for quinolin-8-yl N-propan-2-ylcarbamate is CC(C)NC(=O)Oc1cccc2cccnc12.
What is the InChIKey of quinolin-8-yl N-propan-2-ylcarbamate?
The InChIKey is MYZZZDHUCNJZNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-9(2)15-13(16)17-11-7-3-5-10-6-4-8-14-12(10)11/h3-9H,1-2H3,(H,15,16).
What are the key properties of quinolin-8-yl N-propan-2-ylcarbamate?
quinolin-8-yl N-propan-2-ylcarbamate has a molecular weight of 230.27 g/mol, XLogP of 2.73, 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-propan-2-ylcarbamate is sourced from PubChem (CID 5146618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).