naphthalen-1-yl N,N-dimethylcarbamate

C13H13NO2 — CID 17481

IUPACnaphthalen-1-yl N,N-dimethylcarbamate
SMILESCN(C)C(=O)Oc1cccc2ccccc12
InChIInChI=1S/C13H13NO2/c1-14(2)13(15)16-12-9-5-7-10-6-3-4-8-11(10)12/h3-9H,1-2H3
InChIKeyQNLGINLKNITHFX-UHFFFAOYSA-N
MW215.25 g/mol
LogP2.90
Rot. Bonds1

About naphthalen-1-yl N,N-dimethylcarbamate

naphthalen-1-yl N,N-dimethylcarbamate (PubChem CID 17481) has the molecular formula C13H13NO2 and a molecular weight of 215.25 g/mol. Its IUPAC name is naphthalen-1-yl N,N-dimethylcarbamate.

Molecular Properties

Compound Namenaphthalen-1-yl N,N-dimethylcarbamate
PubChem CID17481
Molecular FormulaC13H13NO2
Molecular Weight215.25 g/mol
Exact Mass215.09
IUPAC Namenaphthalen-1-yl N,N-dimethylcarbamate
SMILESCN(C)C(=O)Oc1cccc2ccccc12
InChIInChI=1S/C13H13NO2/c1-14(2)13(15)16-12-9-5-7-10-6-3-4-8-11(10)12/h3-9H,1-2H3
InChIKeyQNLGINLKNITHFX-UHFFFAOYSA-N
XLogP2.90
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Carbaryl
CID 6129
1-Methoxynaphthalene
CID 16668
1-Naphthyl acetate
CID 13247
Carbonochloridic acid, 1-naphthalenyl ester
CID 19575
5,6,7,8-Tetrahydro-1-naphthyl methylcarbamate
CID 14344
1-naphthalenyl N-methyl-N-nitrosocarbamate
CID 23493
1,4-Diacetoxynaphthalene
CID 79775
2-Methylphenyl N,N-dimethylcarbamate
CID 23730
1,4-Dimethoxynaphthalene
CID 82337
alpha-Naphthyl butyrate
CID 76571
Dimethyl-[3-(naphthalen-1-yloxy)-propyl]-amine
CID 23274477
1,5-Diacetoxynaphthalene
CID 69067

Frequently Asked Questions

What is the IUPAC name of naphthalen-1-yl N,N-dimethylcarbamate?
The IUPAC name of naphthalen-1-yl N,N-dimethylcarbamate (CID 17481) is naphthalen-1-yl N,N-dimethylcarbamate.
What is the SMILES notation for naphthalen-1-yl N,N-dimethylcarbamate?
The canonical SMILES for naphthalen-1-yl N,N-dimethylcarbamate is CN(C)C(=O)Oc1cccc2ccccc12.
What is the InChIKey of naphthalen-1-yl N,N-dimethylcarbamate?
The InChIKey is QNLGINLKNITHFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO2/c1-14(2)13(15)16-12-9-5-7-10-6-3-4-8-11(10)12/h3-9H,1-2H3.
What are the key properties of naphthalen-1-yl N,N-dimethylcarbamate?
naphthalen-1-yl N,N-dimethylcarbamate has a molecular weight of 215.25 g/mol, XLogP of 2.90, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for naphthalen-1-yl N,N-dimethylcarbamate is sourced from PubChem (CID 17481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).