2-(diethylamino)ethyl N-phenylcarbamate

C13H20N2O2 — CID 19538

IUPAC2-(diethylamino)ethyl N-phenylcarbamate
SMILESCCN(CC)CCOC(=O)Nc1ccccc1
InChIInChI=1S/C13H20N2O2/c1-3-15(4-2)10-11-17-13(16)14-12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3,(H,14,16)
InChIKeyMWEVNHAXSNULII-UHFFFAOYSA-N
MW236.32 g/mol
LogP2.58
Rot. Bonds6

About 2-(diethylamino)ethyl N-phenylcarbamate

2-(diethylamino)ethyl N-phenylcarbamate (PubChem CID 19538) has the molecular formula C13H20N2O2 and a molecular weight of 236.32 g/mol. Its IUPAC name is 2-(diethylamino)ethyl N-phenylcarbamate.

Molecular Properties

Compound Name2-(diethylamino)ethyl N-phenylcarbamate
PubChem CID19538
Molecular FormulaC13H20N2O2
Molecular Weight236.32 g/mol
Exact Mass236.15
IUPAC Name2-(diethylamino)ethyl N-phenylcarbamate
SMILESCCN(CC)CCOC(=O)Nc1ccccc1
InChIInChI=1S/C13H20N2O2/c1-3-15(4-2)10-11-17-13(16)14-12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3,(H,14,16)
InChIKeyMWEVNHAXSNULII-UHFFFAOYSA-N
XLogP2.58
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)ethyl N-phenylcarbamate?
The IUPAC name of 2-(diethylamino)ethyl N-phenylcarbamate (CID 19538) is 2-(diethylamino)ethyl N-phenylcarbamate.
What is the SMILES notation for 2-(diethylamino)ethyl N-phenylcarbamate?
The canonical SMILES for 2-(diethylamino)ethyl N-phenylcarbamate is CCN(CC)CCOC(=O)Nc1ccccc1.
What is the InChIKey of 2-(diethylamino)ethyl N-phenylcarbamate?
The InChIKey is MWEVNHAXSNULII-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-3-15(4-2)10-11-17-13(16)14-12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3,(H,14,16).
What are the key properties of 2-(diethylamino)ethyl N-phenylcarbamate?
2-(diethylamino)ethyl N-phenylcarbamate has a molecular weight of 236.32 g/mol, XLogP of 2.58, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)ethyl N-phenylcarbamate is sourced from PubChem (CID 19538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).