benzyl N-(1-naphthalen-1-ylethyl)carbamate

C20H19NO2 — CID 101405185

IUPACbenzyl N-(1-naphthalen-1-ylethyl)carbamate
SMILESCC(NC(=O)OCc1ccccc1)c1cccc2ccccc12
InChIInChI=1S/C20H19NO2/c1-15(18-13-7-11-17-10-5-6-12-19(17)18)21-20(22)23-14-16-8-3-2-4-9-16/h2-13,15H,14H2,1H3,(H,21,22)
InChIKeyNJBJDWBNELDLDS-UHFFFAOYSA-N
MW305.38 g/mol
LogP4.83
Rot. Bonds4

About benzyl N-(1-naphthalen-1-ylethyl)carbamate

benzyl N-(1-naphthalen-1-ylethyl)carbamate (PubChem CID 101405185) has the molecular formula C20H19NO2 and a molecular weight of 305.38 g/mol. Its IUPAC name is benzyl N-(1-naphthalen-1-ylethyl)carbamate.

Molecular Properties

Compound Namebenzyl N-(1-naphthalen-1-ylethyl)carbamate
PubChem CID101405185
Molecular FormulaC20H19NO2
Molecular Weight305.38 g/mol
Exact Mass305.14
IUPAC Namebenzyl N-(1-naphthalen-1-ylethyl)carbamate
SMILESCC(NC(=O)OCc1ccccc1)c1cccc2ccccc12
InChIInChI=1S/C20H19NO2/c1-15(18-13-7-11-17-10-5-6-12-19(17)18)21-20(22)23-14-16-8-3-2-4-9-16/h2-13,15H,14H2,1H3,(H,21,22)
InChIKeyNJBJDWBNELDLDS-UHFFFAOYSA-N
XLogP4.83
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of benzyl N-(1-naphthalen-1-ylethyl)carbamate?
The IUPAC name of benzyl N-(1-naphthalen-1-ylethyl)carbamate (CID 101405185) is benzyl N-(1-naphthalen-1-ylethyl)carbamate.
What is the SMILES notation for benzyl N-(1-naphthalen-1-ylethyl)carbamate?
The canonical SMILES for benzyl N-(1-naphthalen-1-ylethyl)carbamate is CC(NC(=O)OCc1ccccc1)c1cccc2ccccc12.
What is the InChIKey of benzyl N-(1-naphthalen-1-ylethyl)carbamate?
The InChIKey is NJBJDWBNELDLDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO2/c1-15(18-13-7-11-17-10-5-6-12-19(17)18)21-20(22)23-14-16-8-3-2-4-9-16/h2-13,15H,14H2,1H3,(H,21,22).
What are the key properties of benzyl N-(1-naphthalen-1-ylethyl)carbamate?
benzyl N-(1-naphthalen-1-ylethyl)carbamate has a molecular weight of 305.38 g/mol, XLogP of 4.83, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl N-(1-naphthalen-1-ylethyl)carbamate is sourced from PubChem (CID 101405185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).