phenyl N-(3,4-dihydronaphthalen-2-yl)carbamate

C17H15NO2 — CID 15537686

IUPACphenyl N-(3,4-dihydronaphthalen-2-yl)carbamate
SMILESO=C(NC1=Cc2ccccc2CC1)Oc1ccccc1
InChIInChI=1S/C17H15NO2/c19-17(20-16-8-2-1-3-9-16)18-15-11-10-13-6-4-5-7-14(13)12-15/h1-9,12H,10-11H2,(H,18,19)
InChIKeyMUBNAIKSJFQNLP-UHFFFAOYSA-N
MW265.31 g/mol
LogP3.76
Rot. Bonds2

About phenyl N-(3,4-dihydronaphthalen-2-yl)carbamate

phenyl N-(3,4-dihydronaphthalen-2-yl)carbamate (PubChem CID 15537686) has the molecular formula C17H15NO2 and a molecular weight of 265.31 g/mol. Its IUPAC name is phenyl N-(3,4-dihydronaphthalen-2-yl)carbamate.

Molecular Properties

Compound Namephenyl N-(3,4-dihydronaphthalen-2-yl)carbamate
PubChem CID15537686
Molecular FormulaC17H15NO2
Molecular Weight265.31 g/mol
Exact Mass265.11
IUPAC Namephenyl N-(3,4-dihydronaphthalen-2-yl)carbamate
SMILESO=C(NC1=Cc2ccccc2CC1)Oc1ccccc1
InChIInChI=1S/C17H15NO2/c19-17(20-16-8-2-1-3-9-16)18-15-11-10-13-6-4-5-7-14(13)12-15/h1-9,12H,10-11H2,(H,18,19)
InChIKeyMUBNAIKSJFQNLP-UHFFFAOYSA-N
XLogP3.76
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of phenyl N-(3,4-dihydronaphthalen-2-yl)carbamate?
The IUPAC name of phenyl N-(3,4-dihydronaphthalen-2-yl)carbamate (CID 15537686) is phenyl N-(3,4-dihydronaphthalen-2-yl)carbamate.
What is the SMILES notation for phenyl N-(3,4-dihydronaphthalen-2-yl)carbamate?
The canonical SMILES for phenyl N-(3,4-dihydronaphthalen-2-yl)carbamate is O=C(NC1=Cc2ccccc2CC1)Oc1ccccc1.
What is the InChIKey of phenyl N-(3,4-dihydronaphthalen-2-yl)carbamate?
The InChIKey is MUBNAIKSJFQNLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO2/c19-17(20-16-8-2-1-3-9-16)18-15-11-10-13-6-4-5-7-14(13)12-15/h1-9,12H,10-11H2,(H,18,19).
What are the key properties of phenyl N-(3,4-dihydronaphthalen-2-yl)carbamate?
phenyl N-(3,4-dihydronaphthalen-2-yl)carbamate has a molecular weight of 265.31 g/mol, XLogP of 3.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl N-(3,4-dihydronaphthalen-2-yl)carbamate is sourced from PubChem (CID 15537686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).