phenyl N-(2-phenylethyl)carbamate

C15H15NO2 — CID 12632743

IUPACphenyl N-(2-phenylethyl)carbamate
SMILESO=C(NCCc1ccccc1)Oc1ccccc1
InChIInChI=1S/C15H15NO2/c17-15(18-14-9-5-2-6-10-14)16-12-11-13-7-3-1-4-8-13/h1-10H,11-12H2,(H,16,17)
InChIKeyHAXCSBJTTMWOMN-UHFFFAOYSA-N
MW241.29 g/mol
LogP3.02
Rot. Bonds4

About phenyl N-(2-phenylethyl)carbamate

phenyl N-(2-phenylethyl)carbamate (PubChem CID 12632743) has the molecular formula C15H15NO2 and a molecular weight of 241.29 g/mol. Its IUPAC name is phenyl N-(2-phenylethyl)carbamate.

Molecular Properties

Compound Namephenyl N-(2-phenylethyl)carbamate
PubChem CID12632743
Molecular FormulaC15H15NO2
Molecular Weight241.29 g/mol
Exact Mass241.11
IUPAC Namephenyl N-(2-phenylethyl)carbamate
SMILESO=C(NCCc1ccccc1)Oc1ccccc1
InChIInChI=1S/C15H15NO2/c17-15(18-14-9-5-2-6-10-14)16-12-11-13-7-3-1-4-8-13/h1-10H,11-12H2,(H,16,17)
InChIKeyHAXCSBJTTMWOMN-UHFFFAOYSA-N
XLogP3.02
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-methylphenyl) N-(2-phenylethyl)carbamate
CID 10801006
phenyl N-[2-(3-methoxyphenyl)ethyl]carbamate
CID 110755565
phenyl N-(2-hydroxyethyl)carbamate
CID 10932043
phenyl N-[2-(benzylamino)ethyl]carbamate
CID 59371189
phenyl N-[2-[3-(4-methylphenyl)propanoylamino]ethyl]carbamate
CID 108574231
phenyl N-(3-bromopropyl)carbamate
CID 142499000
molecular hydrogen;2-phenylethylcarbamic acid
CID 145072858
tert-butyl N-(2-phenylethyl)carbamate;ethane
CID 177159157
phenyl N-[2-(ethylamino)ethyl]carbamate
CID 62663322
phenyl N-(2-methylsulfanylethyl)carbamate
CID 60637251
phenyl N-[2-(1,3-benzoxazol-6-yl)ethyl]carbamate
CID 110790963
phenyl N-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]carbamate
CID 108736618

Frequently Asked Questions

What is the IUPAC name of phenyl N-(2-phenylethyl)carbamate?
The IUPAC name of phenyl N-(2-phenylethyl)carbamate (CID 12632743) is phenyl N-(2-phenylethyl)carbamate.
What is the SMILES notation for phenyl N-(2-phenylethyl)carbamate?
The canonical SMILES for phenyl N-(2-phenylethyl)carbamate is O=C(NCCc1ccccc1)Oc1ccccc1.
What is the InChIKey of phenyl N-(2-phenylethyl)carbamate?
The InChIKey is HAXCSBJTTMWOMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2/c17-15(18-14-9-5-2-6-10-14)16-12-11-13-7-3-1-4-8-13/h1-10H,11-12H2,(H,16,17).
What are the key properties of phenyl N-(2-phenylethyl)carbamate?
phenyl N-(2-phenylethyl)carbamate has a molecular weight of 241.29 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl N-(2-phenylethyl)carbamate is sourced from PubChem (CID 12632743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).