tert-butyl N-pyridin-2-ylcarbamate

C10H14N2O2 — CID 11206349

IUPACtert-butyl N-pyridin-2-ylcarbamate
SMILESCC(C)(C)OC(=O)Nc1ccccn1
InChIInChI=1S/C10H14N2O2/c1-10(2,3)14-9(13)12-8-6-4-5-7-11-8/h4-7H,1-3H3,(H,11,12,13)
InChIKeyORUGTGTZBRUQIT-UHFFFAOYSA-N
MW194.23 g/mol
LogP2.43
Rot. Bonds1

About tert-butyl N-pyridin-2-ylcarbamate

tert-butyl N-pyridin-2-ylcarbamate (PubChem CID 11206349) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is tert-butyl N-pyridin-2-ylcarbamate.

Molecular Properties

Compound Nametert-butyl N-pyridin-2-ylcarbamate
PubChem CID11206349
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Nametert-butyl N-pyridin-2-ylcarbamate
SMILESCC(C)(C)OC(=O)Nc1ccccn1
InChIInChI=1S/C10H14N2O2/c1-10(2,3)14-9(13)12-8-6-4-5-7-11-8/h4-7H,1-3H3,(H,11,12,13)
InChIKeyORUGTGTZBRUQIT-UHFFFAOYSA-N
XLogP2.43
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze tert-butyl N-pyridin-2-ylcarbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-pyridin-2-ylcarbamate?
The IUPAC name of tert-butyl N-pyridin-2-ylcarbamate (CID 11206349) is tert-butyl N-pyridin-2-ylcarbamate.
What is the SMILES notation for tert-butyl N-pyridin-2-ylcarbamate?
The canonical SMILES for tert-butyl N-pyridin-2-ylcarbamate is CC(C)(C)OC(=O)Nc1ccccn1.
What is the InChIKey of tert-butyl N-pyridin-2-ylcarbamate?
The InChIKey is ORUGTGTZBRUQIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-10(2,3)14-9(13)12-8-6-4-5-7-11-8/h4-7H,1-3H3,(H,11,12,13).
What are the key properties of tert-butyl N-pyridin-2-ylcarbamate?
tert-butyl N-pyridin-2-ylcarbamate has a molecular weight of 194.23 g/mol, XLogP of 2.43, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-pyridin-2-ylcarbamate is sourced from PubChem (CID 11206349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).