5-chloro-2-N-(4-chlorophenyl)-2-N-methylpyridine-2,3-diamine

C12H11Cl2N3 — CID 67905407

IUPAC5-chloro-2-N-(4-chlorophenyl)-2-N-methylpyridine-2,3-diamine
SMILESCN(c1ccc(Cl)cc1)c1ncc(Cl)cc1N
InChIInChI=1S/C12H11Cl2N3/c1-17(10-4-2-8(13)3-5-10)12-11(15)6-9(14)7-16-12/h2-7H,15H2,1H3
InChIKeyGPVCJRRSMMCJIE-UHFFFAOYSA-N
MW268.15 g/mol
LogP3.74
Rot. Bonds2

About 5-chloro-2-N-(4-chlorophenyl)-2-N-methylpyridine-2,3-diamine

5-chloro-2-N-(4-chlorophenyl)-2-N-methylpyridine-2,3-diamine (PubChem CID 67905407) has the molecular formula C12H11Cl2N3 and a molecular weight of 268.15 g/mol. Its IUPAC name is 5-chloro-2-N-(4-chlorophenyl)-2-N-methylpyridine-2,3-diamine.

Molecular Properties

Compound Name5-chloro-2-N-(4-chlorophenyl)-2-N-methylpyridine-2,3-diamine
PubChem CID67905407
Molecular FormulaC12H11Cl2N3
Molecular Weight268.15 g/mol
Exact Mass267.03
IUPAC Name5-chloro-2-N-(4-chlorophenyl)-2-N-methylpyridine-2,3-diamine
SMILESCN(c1ccc(Cl)cc1)c1ncc(Cl)cc1N
InChIInChI=1S/C12H11Cl2N3/c1-17(10-4-2-8(13)3-5-10)12-11(15)6-9(14)7-16-12/h2-7H,15H2,1H3
InChIKeyGPVCJRRSMMCJIE-UHFFFAOYSA-N
XLogP3.74
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.15
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-N-(4-chlorophenyl)-2-N-methylpyridine-2,3-diamine?
The IUPAC name of 5-chloro-2-N-(4-chlorophenyl)-2-N-methylpyridine-2,3-diamine (CID 67905407) is 5-chloro-2-N-(4-chlorophenyl)-2-N-methylpyridine-2,3-diamine.
What is the SMILES notation for 5-chloro-2-N-(4-chlorophenyl)-2-N-methylpyridine-2,3-diamine?
The canonical SMILES for 5-chloro-2-N-(4-chlorophenyl)-2-N-methylpyridine-2,3-diamine is CN(c1ccc(Cl)cc1)c1ncc(Cl)cc1N.
What is the InChIKey of 5-chloro-2-N-(4-chlorophenyl)-2-N-methylpyridine-2,3-diamine?
The InChIKey is GPVCJRRSMMCJIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11Cl2N3/c1-17(10-4-2-8(13)3-5-10)12-11(15)6-9(14)7-16-12/h2-7H,15H2,1H3.
What are the key properties of 5-chloro-2-N-(4-chlorophenyl)-2-N-methylpyridine-2,3-diamine?
5-chloro-2-N-(4-chlorophenyl)-2-N-methylpyridine-2,3-diamine has a molecular weight of 268.15 g/mol, XLogP of 3.74, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-N-(4-chlorophenyl)-2-N-methylpyridine-2,3-diamine is sourced from PubChem (CID 67905407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).