(2-cyclopentylphenyl) N-methylcarbamate

C13H17NO2 — CID 18666

IUPAC(2-cyclopentylphenyl) N-methylcarbamate
SMILESCNC(=O)Oc1ccccc1C1CCCC1
InChIInChI=1S/C13H17NO2/c1-14-13(15)16-12-9-5-4-8-11(12)10-6-2-3-7-10/h4-5,8-10H,2-3,6-7H2,1H3,(H,14,15)
InChIKeyLQQCVZUWEMLEGT-UHFFFAOYSA-N
MW219.28 g/mol
LogP3.06
Rot. Bonds2

About (2-cyclopentylphenyl) N-methylcarbamate

(2-cyclopentylphenyl) N-methylcarbamate (PubChem CID 18666) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is (2-cyclopentylphenyl) N-methylcarbamate.

Molecular Properties

Compound Name(2-cyclopentylphenyl) N-methylcarbamate
PubChem CID18666
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC Name(2-cyclopentylphenyl) N-methylcarbamate
SMILESCNC(=O)Oc1ccccc1C1CCCC1
InChIInChI=1S/C13H17NO2/c1-14-13(15)16-12-9-5-4-8-11(12)10-6-2-3-7-10/h4-5,8-10H,2-3,6-7H2,1H3,(H,14,15)
InChIKeyLQQCVZUWEMLEGT-UHFFFAOYSA-N
XLogP3.06
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-cyclopentylphenyl) N-methylcarbamate?
The IUPAC name of (2-cyclopentylphenyl) N-methylcarbamate (CID 18666) is (2-cyclopentylphenyl) N-methylcarbamate.
What is the SMILES notation for (2-cyclopentylphenyl) N-methylcarbamate?
The canonical SMILES for (2-cyclopentylphenyl) N-methylcarbamate is CNC(=O)Oc1ccccc1C1CCCC1.
What is the InChIKey of (2-cyclopentylphenyl) N-methylcarbamate?
The InChIKey is LQQCVZUWEMLEGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2/c1-14-13(15)16-12-9-5-4-8-11(12)10-6-2-3-7-10/h4-5,8-10H,2-3,6-7H2,1H3,(H,14,15).
What are the key properties of (2-cyclopentylphenyl) N-methylcarbamate?
(2-cyclopentylphenyl) N-methylcarbamate has a molecular weight of 219.28 g/mol, XLogP of 3.06, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopentylphenyl) N-methylcarbamate is sourced from PubChem (CID 18666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).