propan-2-yl N-(4-phenylphenyl)carbamate

C16H17NO2 — CID 15965628

IUPACpropan-2-yl N-(4-phenylphenyl)carbamate
SMILESCC(C)OC(=O)Nc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C16H17NO2/c1-12(2)19-16(18)17-15-10-8-14(9-11-15)13-6-4-3-5-7-13/h3-12H,1-2H3,(H,17,18)
InChIKeyMFRKXEDWOCJRKK-UHFFFAOYSA-N
MW255.32 g/mol
LogP4.31
Rot. Bonds3

About propan-2-yl N-(4-phenylphenyl)carbamate

propan-2-yl N-(4-phenylphenyl)carbamate (PubChem CID 15965628) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is propan-2-yl N-(4-phenylphenyl)carbamate.

Molecular Properties

Compound Namepropan-2-yl N-(4-phenylphenyl)carbamate
PubChem CID15965628
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC Namepropan-2-yl N-(4-phenylphenyl)carbamate
SMILESCC(C)OC(=O)Nc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C16H17NO2/c1-12(2)19-16(18)17-15-10-8-14(9-11-15)13-6-4-3-5-7-13/h3-12H,1-2H3,(H,17,18)
InChIKeyMFRKXEDWOCJRKK-UHFFFAOYSA-N
XLogP4.31
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of propan-2-yl N-(4-phenylphenyl)carbamate?
The IUPAC name of propan-2-yl N-(4-phenylphenyl)carbamate (CID 15965628) is propan-2-yl N-(4-phenylphenyl)carbamate.
What is the SMILES notation for propan-2-yl N-(4-phenylphenyl)carbamate?
The canonical SMILES for propan-2-yl N-(4-phenylphenyl)carbamate is CC(C)OC(=O)Nc1ccc(-c2ccccc2)cc1.
What is the InChIKey of propan-2-yl N-(4-phenylphenyl)carbamate?
The InChIKey is MFRKXEDWOCJRKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c1-12(2)19-16(18)17-15-10-8-14(9-11-15)13-6-4-3-5-7-13/h3-12H,1-2H3,(H,17,18).
What are the key properties of propan-2-yl N-(4-phenylphenyl)carbamate?
propan-2-yl N-(4-phenylphenyl)carbamate has a molecular weight of 255.32 g/mol, XLogP of 4.31, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl N-(4-phenylphenyl)carbamate is sourced from PubChem (CID 15965628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).