2-phenylethyl N-(2-cyclopentylethyl)carbamate

C16H23NO2 — CID 54511060

IUPAC2-phenylethyl N-(2-cyclopentylethyl)carbamate
SMILESO=C(NCCC1CCCC1)OCCc1ccccc1
InChIInChI=1S/C16H23NO2/c18-16(17-12-10-14-8-4-5-9-14)19-13-11-15-6-2-1-3-7-15/h1-3,6-7,14H,4-5,8-13H2,(H,17,18)
InChIKeyCRZAGYOMCICCQT-UHFFFAOYSA-N
MW261.36 g/mol
LogP3.54
Rot. Bonds6

About 2-phenylethyl N-(2-cyclopentylethyl)carbamate

2-phenylethyl N-(2-cyclopentylethyl)carbamate (PubChem CID 54511060) has the molecular formula C16H23NO2 and a molecular weight of 261.36 g/mol. Its IUPAC name is 2-phenylethyl N-(2-cyclopentylethyl)carbamate.

Molecular Properties

Compound Name2-phenylethyl N-(2-cyclopentylethyl)carbamate
PubChem CID54511060
Molecular FormulaC16H23NO2
Molecular Weight261.36 g/mol
Exact Mass261.17
IUPAC Name2-phenylethyl N-(2-cyclopentylethyl)carbamate
SMILESO=C(NCCC1CCCC1)OCCc1ccccc1
InChIInChI=1S/C16H23NO2/c18-16(17-12-10-14-8-4-5-9-14)19-13-11-15-6-2-1-3-7-15/h1-3,6-7,14H,4-5,8-13H2,(H,17,18)
InChIKeyCRZAGYOMCICCQT-UHFFFAOYSA-N
XLogP3.54
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.36
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-phenylethyl N-(2-cycloheptylethyl)carbamate
CID 54473124
3-phenylpropyl N-(2-cyclopentylethyl)carbamate
CID 54331746
2-phenylethyl N-(cyclopentylmethyl)carbamate
CID 57081280
3-phenylpropyl N-(3-cycloheptylpropyl)carbamate
CID 54329594
2-phenylethyl 3-cyclopentylpropanoate
CID 568730
1-(2-cyclopentylethyl)-3-(3-phenylpropyl)urea
CID 55570336
2-phenylethyl N-(4-phenylbutyl)carbamate
CID 23058488
benzyl N-[2-(8,8-dioxo-8λ6-thiabicyclo[3.2.1]octan-3-yl)ethyl]carbamate
CID 171936859
benzyl N-[2-(9-thiabicyclo[3.3.1]nonan-3-yl)ethyl]carbamate
CID 171936866
benzyl N-[2-(8-oxabicyclo[3.2.1]octan-3-yl)ethyl]carbamate
CID 171936856
benzyl N-[2-[(3S)-pyrrolidin-3-yl]ethyl]carbamate
CID 97170433
(2S)-2-amino-N-(2-cyclopentylethyl)-3-phenylpropanamide;hydrochloride
CID 119289813

Frequently Asked Questions

What is the IUPAC name of 2-phenylethyl N-(2-cyclopentylethyl)carbamate?
The IUPAC name of 2-phenylethyl N-(2-cyclopentylethyl)carbamate (CID 54511060) is 2-phenylethyl N-(2-cyclopentylethyl)carbamate.
What is the SMILES notation for 2-phenylethyl N-(2-cyclopentylethyl)carbamate?
The canonical SMILES for 2-phenylethyl N-(2-cyclopentylethyl)carbamate is O=C(NCCC1CCCC1)OCCc1ccccc1.
What is the InChIKey of 2-phenylethyl N-(2-cyclopentylethyl)carbamate?
The InChIKey is CRZAGYOMCICCQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c18-16(17-12-10-14-8-4-5-9-14)19-13-11-15-6-2-1-3-7-15/h1-3,6-7,14H,4-5,8-13H2,(H,17,18).
What are the key properties of 2-phenylethyl N-(2-cyclopentylethyl)carbamate?
2-phenylethyl N-(2-cyclopentylethyl)carbamate has a molecular weight of 261.36 g/mol, XLogP of 3.54, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylethyl N-(2-cyclopentylethyl)carbamate is sourced from PubChem (CID 54511060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).