pyridin-3-yl N-(2,5-dichlorophenyl)carbamate

C12H8Cl2N2O2 — CID 4143685

IUPACpyridin-3-yl N-(2,5-dichlorophenyl)carbamate
SMILESO=C(Nc1cc(Cl)ccc1Cl)Oc1cccnc1
InChIInChI=1S/C12H8Cl2N2O2/c13-8-3-4-10(14)11(6-8)16-12(17)18-9-2-1-5-15-7-9/h1-7H,(H,16,17)
InChIKeyNMLCGIMNGWRECL-UHFFFAOYSA-N
MW283.11 g/mol
LogP4.00
Rot. Bonds2

About pyridin-3-yl N-(2,5-dichlorophenyl)carbamate

pyridin-3-yl N-(2,5-dichlorophenyl)carbamate (PubChem CID 4143685) has the molecular formula C12H8Cl2N2O2 and a molecular weight of 283.11 g/mol. Its IUPAC name is pyridin-3-yl N-(2,5-dichlorophenyl)carbamate.

Molecular Properties

Compound Namepyridin-3-yl N-(2,5-dichlorophenyl)carbamate
PubChem CID4143685
Molecular FormulaC12H8Cl2N2O2
Molecular Weight283.11 g/mol
Exact Mass282.00
IUPAC Namepyridin-3-yl N-(2,5-dichlorophenyl)carbamate
SMILESO=C(Nc1cc(Cl)ccc1Cl)Oc1cccnc1
InChIInChI=1S/C12H8Cl2N2O2/c13-8-3-4-10(14)11(6-8)16-12(17)18-9-2-1-5-15-7-9/h1-7H,(H,16,17)
InChIKeyNMLCGIMNGWRECL-UHFFFAOYSA-N
XLogP4.00
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.11
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze pyridin-3-yl N-(2,5-dichlorophenyl)carbamate with MolForge

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

Launch Full Analysis

Related Compounds

(3,5-dichlorophenyl) N-(2,5-dichlorophenyl)carbamate
CID 134103774
pyridin-3-yl N-(2,5-dichlorothiophen-3-yl)carbamate
CID 3375793
(3-amino-4-methoxyphenyl) N-(2,5-dichlorophenyl)carbamate
CID 70556220
tert-butyl N-(2,5-dichlorophenyl)carbamate
CID 4935502
2-hydroxyethyl N-(2,5-dichlorophenyl)carbamate
CID 79346256
N-(2,5-dichlorophenyl)pyridine-3-sulfonamide
CID 16638548
2-N,6-N-bis(2,5-dichlorophenyl)pyridine-2,6-dicarboxamide
CID 4104861
pyridin-3-yl 2-(4-chlorophenyl)-3-methylbutanoate
CID 174421603
N-(2,5-dichlorophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide
CID 109171976
N-(2,5-dichlorophenyl)-2-(6-pyridin-3-ylpyridazin-3-yl)sulfanylacetamide
CID 7688153
1-(2,4-dichlorophenyl)-3-pyridin-3-ylurea
CID 3994543
(2R)-N-(2,5-dichlorophenyl)-2-phenoxypropanamide
CID 7723452

Frequently Asked Questions

What is the IUPAC name of pyridin-3-yl N-(2,5-dichlorophenyl)carbamate?
The IUPAC name of pyridin-3-yl N-(2,5-dichlorophenyl)carbamate (CID 4143685) is pyridin-3-yl N-(2,5-dichlorophenyl)carbamate.
What is the SMILES notation for pyridin-3-yl N-(2,5-dichlorophenyl)carbamate?
The canonical SMILES for pyridin-3-yl N-(2,5-dichlorophenyl)carbamate is O=C(Nc1cc(Cl)ccc1Cl)Oc1cccnc1.
What is the InChIKey of pyridin-3-yl N-(2,5-dichlorophenyl)carbamate?
The InChIKey is NMLCGIMNGWRECL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Cl2N2O2/c13-8-3-4-10(14)11(6-8)16-12(17)18-9-2-1-5-15-7-9/h1-7H,(H,16,17).
What are the key properties of pyridin-3-yl N-(2,5-dichlorophenyl)carbamate?
pyridin-3-yl N-(2,5-dichlorophenyl)carbamate has a molecular weight of 283.11 g/mol, XLogP of 4.00, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pyridin-3-yl N-(2,5-dichlorophenyl)carbamate is sourced from PubChem (CID 4143685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).