naphthalen-1-ylmethyl N-cyclohexylcarbamate

C18H21NO2 — CID 22978777

IUPACnaphthalen-1-ylmethyl N-cyclohexylcarbamate
SMILESO=C(NC1CCCCC1)OCc1cccc2ccccc12
InChIInChI=1S/C18H21NO2/c20-18(19-16-10-2-1-3-11-16)21-13-15-9-6-8-14-7-4-5-12-17(14)15/h4-9,12,16H,1-3,10-11,13H2,(H,19,20)
InChIKeyPQGOXTQFBHEIHR-UHFFFAOYSA-N
MW283.37 g/mol
LogP4.40
Rot. Bonds3

About naphthalen-1-ylmethyl N-cyclohexylcarbamate

naphthalen-1-ylmethyl N-cyclohexylcarbamate (PubChem CID 22978777) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is naphthalen-1-ylmethyl N-cyclohexylcarbamate.

Molecular Properties

Compound Namenaphthalen-1-ylmethyl N-cyclohexylcarbamate
PubChem CID22978777
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC Namenaphthalen-1-ylmethyl N-cyclohexylcarbamate
SMILESO=C(NC1CCCCC1)OCc1cccc2ccccc12
InChIInChI=1S/C18H21NO2/c20-18(19-16-10-2-1-3-11-16)21-13-15-9-6-8-14-7-4-5-12-17(14)15/h4-9,12,16H,1-3,10-11,13H2,(H,19,20)
InChIKeyPQGOXTQFBHEIHR-UHFFFAOYSA-N
XLogP4.40
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of naphthalen-1-ylmethyl N-cyclohexylcarbamate?
The IUPAC name of naphthalen-1-ylmethyl N-cyclohexylcarbamate (CID 22978777) is naphthalen-1-ylmethyl N-cyclohexylcarbamate.
What is the SMILES notation for naphthalen-1-ylmethyl N-cyclohexylcarbamate?
The canonical SMILES for naphthalen-1-ylmethyl N-cyclohexylcarbamate is O=C(NC1CCCCC1)OCc1cccc2ccccc12.
What is the InChIKey of naphthalen-1-ylmethyl N-cyclohexylcarbamate?
The InChIKey is PQGOXTQFBHEIHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c20-18(19-16-10-2-1-3-11-16)21-13-15-9-6-8-14-7-4-5-12-17(14)15/h4-9,12,16H,1-3,10-11,13H2,(H,19,20).
What are the key properties of naphthalen-1-ylmethyl N-cyclohexylcarbamate?
naphthalen-1-ylmethyl N-cyclohexylcarbamate has a molecular weight of 283.37 g/mol, XLogP of 4.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for naphthalen-1-ylmethyl N-cyclohexylcarbamate is sourced from PubChem (CID 22978777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).