ethyl N-phenyl-N-pyridin-2-ylcarbamate

C14H14N2O2 — CID 2783435

IUPACethyl N-phenyl-N-pyridin-2-ylcarbamate
SMILESCCOC(=O)N(c1ccccc1)c1ccccn1
InChIInChI=1S/C14H14N2O2/c1-2-18-14(17)16(12-8-4-3-5-9-12)13-10-6-7-11-15-13/h3-11H,2H2,1H3
InChIKeyVDYGNWAMRLGJLX-UHFFFAOYSA-N
MW242.28 g/mol
LogP3.38
Rot. Bonds3

About ethyl N-phenyl-N-pyridin-2-ylcarbamate

ethyl N-phenyl-N-pyridin-2-ylcarbamate (PubChem CID 2783435) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is ethyl N-phenyl-N-pyridin-2-ylcarbamate.

Molecular Properties

Compound Nameethyl N-phenyl-N-pyridin-2-ylcarbamate
PubChem CID2783435
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Nameethyl N-phenyl-N-pyridin-2-ylcarbamate
SMILESCCOC(=O)N(c1ccccc1)c1ccccn1
InChIInChI=1S/C14H14N2O2/c1-2-18-14(17)16(12-8-4-3-5-9-12)13-10-6-7-11-15-13/h3-11H,2H2,1H3
InChIKeyVDYGNWAMRLGJLX-UHFFFAOYSA-N
XLogP3.38
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl N-phenyl-N-pyridin-2-ylcarbamate?
The IUPAC name of ethyl N-phenyl-N-pyridin-2-ylcarbamate (CID 2783435) is ethyl N-phenyl-N-pyridin-2-ylcarbamate.
What is the SMILES notation for ethyl N-phenyl-N-pyridin-2-ylcarbamate?
The canonical SMILES for ethyl N-phenyl-N-pyridin-2-ylcarbamate is CCOC(=O)N(c1ccccc1)c1ccccn1.
What is the InChIKey of ethyl N-phenyl-N-pyridin-2-ylcarbamate?
The InChIKey is VDYGNWAMRLGJLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-2-18-14(17)16(12-8-4-3-5-9-12)13-10-6-7-11-15-13/h3-11H,2H2,1H3.
What are the key properties of ethyl N-phenyl-N-pyridin-2-ylcarbamate?
ethyl N-phenyl-N-pyridin-2-ylcarbamate has a molecular weight of 242.28 g/mol, XLogP of 3.38, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-phenyl-N-pyridin-2-ylcarbamate is sourced from PubChem (CID 2783435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).