(1-ethylnaphthalen-2-yl) N,N-dimethylcarbamate

C15H17NO2 — CID 70684701

IUPAC(1-ethylnaphthalen-2-yl) N,N-dimethylcarbamate
SMILESCCc1c(OC(=O)N(C)C)ccc2ccccc12
InChIInChI=1S/C15H17NO2/c1-4-12-13-8-6-5-7-11(13)9-10-14(12)18-15(17)16(2)3/h5-10H,4H2,1-3H3
InChIKeyLBDJEDUKOHTDSZ-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.46
Rot. Bonds2

About (1-ethylnaphthalen-2-yl) N,N-dimethylcarbamate

(1-ethylnaphthalen-2-yl) N,N-dimethylcarbamate (PubChem CID 70684701) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is (1-ethylnaphthalen-2-yl) N,N-dimethylcarbamate.

Molecular Properties

Compound Name(1-ethylnaphthalen-2-yl) N,N-dimethylcarbamate
PubChem CID70684701
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name(1-ethylnaphthalen-2-yl) N,N-dimethylcarbamate
SMILESCCc1c(OC(=O)N(C)C)ccc2ccccc12
InChIInChI=1S/C15H17NO2/c1-4-12-13-8-6-5-7-11(13)9-10-14(12)18-15(17)16(2)3/h5-10H,4H2,1-3H3
InChIKeyLBDJEDUKOHTDSZ-UHFFFAOYSA-N
XLogP3.46
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-ethylnaphthalen-2-yl) N,N-dimethylcarbamate?
The IUPAC name of (1-ethylnaphthalen-2-yl) N,N-dimethylcarbamate (CID 70684701) is (1-ethylnaphthalen-2-yl) N,N-dimethylcarbamate.
What is the SMILES notation for (1-ethylnaphthalen-2-yl) N,N-dimethylcarbamate?
The canonical SMILES for (1-ethylnaphthalen-2-yl) N,N-dimethylcarbamate is CCc1c(OC(=O)N(C)C)ccc2ccccc12.
What is the InChIKey of (1-ethylnaphthalen-2-yl) N,N-dimethylcarbamate?
The InChIKey is LBDJEDUKOHTDSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-4-12-13-8-6-5-7-11(13)9-10-14(12)18-15(17)16(2)3/h5-10H,4H2,1-3H3.
What are the key properties of (1-ethylnaphthalen-2-yl) N,N-dimethylcarbamate?
(1-ethylnaphthalen-2-yl) N,N-dimethylcarbamate has a molecular weight of 243.31 g/mol, XLogP of 3.46, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethylnaphthalen-2-yl) N,N-dimethylcarbamate is sourced from PubChem (CID 70684701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).