(5-chloro-2-pyridinyl) N-(2,5-difluorophenyl)carbamate

C12H7ClF2N2O2 — CID 134113793

IUPAC(5-chloro-2-pyridinyl) N-(2,5-difluorophenyl)carbamate
SMILESO=C(Nc1cc(F)ccc1F)Oc1ccc(Cl)cn1
InChIInChI=1S/C12H7ClF2N2O2/c13-7-1-4-11(16-6-7)19-12(18)17-10-5-8(14)2-3-9(10)15/h1-6H,(H,17,18)
InChIKeyZBWBFGXAKOFELX-UHFFFAOYSA-N
MW284.65 g/mol
LogP3.62
Rot. Bonds2

About (5-chloro-2-pyridinyl) N-(2,5-difluorophenyl)carbamate

(5-chloro-2-pyridinyl) N-(2,5-difluorophenyl)carbamate (PubChem CID 134113793) has the molecular formula C12H7ClF2N2O2 and a molecular weight of 284.65 g/mol. Its IUPAC name is (5-chloro-2-pyridinyl) N-(2,5-difluorophenyl)carbamate.

Molecular Properties

Compound Name(5-chloro-2-pyridinyl) N-(2,5-difluorophenyl)carbamate
PubChem CID134113793
Molecular FormulaC12H7ClF2N2O2
Molecular Weight284.65 g/mol
Exact Mass284.02
IUPAC Name(5-chloro-2-pyridinyl) N-(2,5-difluorophenyl)carbamate
SMILESO=C(Nc1cc(F)ccc1F)Oc1ccc(Cl)cn1
InChIInChI=1S/C12H7ClF2N2O2/c13-7-1-4-11(16-6-7)19-12(18)17-10-5-8(14)2-3-9(10)15/h1-6H,(H,17,18)
InChIKeyZBWBFGXAKOFELX-UHFFFAOYSA-N
XLogP3.62
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.65
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-2-(2-chloro-4-fluorophenoxy)pyridine
CID 66234554
tert-butyl N-(2,5-difluorophenyl)carbamate
CID 14690685
pyridin-4-ylmethyl N-(2,5-difluorophenyl)carbamate
CID 134113794
2-(2-chloro-4-fluorophenoxy)-N-(2,5-difluorophenyl)acetamide
CID 30273064
4-chloro-N-(2,5-difluorophenyl)benzamide
CID 2969912
5-bromo-N-(2,5-difluorophenyl)pyridine-2-carboxamide
CID 62952498
methyl N-(5-chloro-2-fluorophenyl)carbamate
CID 110778567
6-amino-N-(2,5-difluorophenyl)pyridine-3-carboxamide
CID 62152342
2-chloro-N-(2,5-difluorophenyl)-4-fluorobenzamide
CID 26361023
1-(2,5-difluorophenyl)-3-(2-methoxypyrimidin-5-yl)urea
CID 122301482
N-(2,5-difluorophenyl)-5-(propylamino)pyridine-2-carboxamide
CID 104639737
N'-(5-chloro-2-methylphenyl)-N-(2,5-difluorophenyl)oxamide
CID 108511873

Frequently Asked Questions

What is the IUPAC name of (5-chloro-2-pyridinyl) N-(2,5-difluorophenyl)carbamate?
The IUPAC name of (5-chloro-2-pyridinyl) N-(2,5-difluorophenyl)carbamate (CID 134113793) is (5-chloro-2-pyridinyl) N-(2,5-difluorophenyl)carbamate.
What is the SMILES notation for (5-chloro-2-pyridinyl) N-(2,5-difluorophenyl)carbamate?
The canonical SMILES for (5-chloro-2-pyridinyl) N-(2,5-difluorophenyl)carbamate is O=C(Nc1cc(F)ccc1F)Oc1ccc(Cl)cn1.
What is the InChIKey of (5-chloro-2-pyridinyl) N-(2,5-difluorophenyl)carbamate?
The InChIKey is ZBWBFGXAKOFELX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7ClF2N2O2/c13-7-1-4-11(16-6-7)19-12(18)17-10-5-8(14)2-3-9(10)15/h1-6H,(H,17,18).
What are the key properties of (5-chloro-2-pyridinyl) N-(2,5-difluorophenyl)carbamate?
(5-chloro-2-pyridinyl) N-(2,5-difluorophenyl)carbamate has a molecular weight of 284.65 g/mol, XLogP of 3.62, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-2-pyridinyl) N-(2,5-difluorophenyl)carbamate is sourced from PubChem (CID 134113793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).