ethyl N-[(4-phenylphenyl)methyl]carbamate

C16H17NO2 — CID 90935573

IUPACethyl N-[(4-phenylphenyl)methyl]carbamate
SMILESCCOC(=O)NCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C16H17NO2/c1-2-19-16(18)17-12-13-8-10-15(11-9-13)14-6-4-3-5-7-14/h3-11H,2,12H2,1H3,(H,17,18)
InChIKeySGDYUDMCLMIBPA-UHFFFAOYSA-N
MW255.32 g/mol
LogP3.60
Rot. Bonds4

About ethyl N-[(4-phenylphenyl)methyl]carbamate

ethyl N-[(4-phenylphenyl)methyl]carbamate (PubChem CID 90935573) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is ethyl N-[(4-phenylphenyl)methyl]carbamate.

Molecular Properties

Compound Nameethyl N-[(4-phenylphenyl)methyl]carbamate
PubChem CID90935573
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC Nameethyl N-[(4-phenylphenyl)methyl]carbamate
SMILESCCOC(=O)NCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C16H17NO2/c1-2-19-16(18)17-12-13-8-10-15(11-9-13)14-6-4-3-5-7-14/h3-11H,2,12H2,1H3,(H,17,18)
InChIKeySGDYUDMCLMIBPA-UHFFFAOYSA-N
XLogP3.60
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

benzene;ethyl N-benzylcarbamate
CID 67715166
(4-phenylphenyl) N-benzylcarbamate
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ethyl N-(benzylcarbamoyl)carbamate
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[2-[(ethoxycarbonylamino)methyl]phenyl]methylcarbamic acid
CID 175218190
ethyl N-[(4-carbamothioylphenyl)methyl]carbamate
CID 62311623
ethyl N-[(4-sulfamoylphenyl)methyl]carbamate
CID 5054603
(4-fluorophenyl) N-[(4-phenylphenyl)methyl]carbamate
CID 68577471
1,1,2-trifluoroethyl N-[(4-phenylphenyl)methyl]carbamate
CID 157060389
N-[(4-methylphenyl)methyl]-4-phenylbenzamide
CID 1228171
ethyl N-[(3,4-diaminophenyl)methyl]carbamate
CID 130366044
ethyl N-[[4-[1-hydroxy-1-(methylamino)-3-phenylpropyl]phenyl]methyl]carbamate
CID 150783434
ethyl 2-[[2-(4-phenylphenyl)acetyl]amino]acetate
CID 163761967

Frequently Asked Questions

What is the IUPAC name of ethyl N-[(4-phenylphenyl)methyl]carbamate?
The IUPAC name of ethyl N-[(4-phenylphenyl)methyl]carbamate (CID 90935573) is ethyl N-[(4-phenylphenyl)methyl]carbamate.
What is the SMILES notation for ethyl N-[(4-phenylphenyl)methyl]carbamate?
The canonical SMILES for ethyl N-[(4-phenylphenyl)methyl]carbamate is CCOC(=O)NCc1ccc(-c2ccccc2)cc1.
What is the InChIKey of ethyl N-[(4-phenylphenyl)methyl]carbamate?
The InChIKey is SGDYUDMCLMIBPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c1-2-19-16(18)17-12-13-8-10-15(11-9-13)14-6-4-3-5-7-14/h3-11H,2,12H2,1H3,(H,17,18).
What are the key properties of ethyl N-[(4-phenylphenyl)methyl]carbamate?
ethyl N-[(4-phenylphenyl)methyl]carbamate has a molecular weight of 255.32 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[(4-phenylphenyl)methyl]carbamate is sourced from PubChem (CID 90935573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).