pyridin-2-yl N-phenylcarbamate

C12H10N2O2 — CID 4689975

IUPACpyridin-2-yl N-phenylcarbamate
SMILESO=C(Nc1ccccc1)Oc1ccccn1
InChIInChI=1S/C12H10N2O2/c15-12(14-10-6-2-1-3-7-10)16-11-8-4-5-9-13-11/h1-9H,(H,14,15)
InChIKeyNMQVKCSSLPARTC-UHFFFAOYSA-N
MW214.22 g/mol
LogP2.69
Rot. Bonds2

About pyridin-2-yl N-phenylcarbamate

pyridin-2-yl N-phenylcarbamate (PubChem CID 4689975) has the molecular formula C12H10N2O2 and a molecular weight of 214.22 g/mol. Its IUPAC name is pyridin-2-yl N-phenylcarbamate.

Molecular Properties

Compound Namepyridin-2-yl N-phenylcarbamate
PubChem CID4689975
Molecular FormulaC12H10N2O2
Molecular Weight214.22 g/mol
Exact Mass214.07
IUPAC Namepyridin-2-yl N-phenylcarbamate
SMILESO=C(Nc1ccccc1)Oc1ccccn1
InChIInChI=1S/C12H10N2O2/c15-12(14-10-6-2-1-3-7-10)16-11-8-4-5-9-13-11/h1-9H,(H,14,15)
InChIKeyNMQVKCSSLPARTC-UHFFFAOYSA-N
XLogP2.69
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.22
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of pyridin-2-yl N-phenylcarbamate?
The IUPAC name of pyridin-2-yl N-phenylcarbamate (CID 4689975) is pyridin-2-yl N-phenylcarbamate.
What is the SMILES notation for pyridin-2-yl N-phenylcarbamate?
The canonical SMILES for pyridin-2-yl N-phenylcarbamate is O=C(Nc1ccccc1)Oc1ccccn1.
What is the InChIKey of pyridin-2-yl N-phenylcarbamate?
The InChIKey is NMQVKCSSLPARTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2O2/c15-12(14-10-6-2-1-3-7-10)16-11-8-4-5-9-13-11/h1-9H,(H,14,15).
What are the key properties of pyridin-2-yl N-phenylcarbamate?
pyridin-2-yl N-phenylcarbamate has a molecular weight of 214.22 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pyridin-2-yl N-phenylcarbamate is sourced from PubChem (CID 4689975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).