6-chloro-N-(4,5-dichloro-2-methylphenyl)pyridin-2-amine;ethane

C14H15Cl3N2 — CID 144720384

IUPAC6-chloro-N-(4,5-dichloro-2-methylphenyl)pyridin-2-amine;ethane
SMILESCC.Cc1cc(Cl)c(Cl)cc1Nc1cccc(Cl)n1
InChIInChI=1S/C12H9Cl3N2.C2H6/c1-7-5-8(13)9(14)6-10(7)16-12-4-2-3-11(15)17-12;1-2/h2-6H,1H3,(H,16,17);1-2H3
InChIKeyOFGVEDGXHAEUOW-UHFFFAOYSA-N
MW317.65 g/mol
LogP6.12
Rot. Bonds2

About 6-chloro-N-(4,5-dichloro-2-methylphenyl)pyridin-2-amine;ethane

6-chloro-N-(4,5-dichloro-2-methylphenyl)pyridin-2-amine;ethane (PubChem CID 144720384) has the molecular formula C14H15Cl3N2 and a molecular weight of 317.65 g/mol. Its IUPAC name is 6-chloro-N-(4,5-dichloro-2-methylphenyl)pyridin-2-amine;ethane.

Molecular Properties

Compound Name6-chloro-N-(4,5-dichloro-2-methylphenyl)pyridin-2-amine;ethane
PubChem CID144720384
Molecular FormulaC14H15Cl3N2
Molecular Weight317.65 g/mol
Exact Mass316.03
IUPAC Name6-chloro-N-(4,5-dichloro-2-methylphenyl)pyridin-2-amine;ethane
SMILESCC.Cc1cc(Cl)c(Cl)cc1Nc1cccc(Cl)n1
InChIInChI=1S/C12H9Cl3N2.C2H6/c1-7-5-8(13)9(14)6-10(7)16-12-4-2-3-11(15)17-12;1-2/h2-6H,1H3,(H,16,17);1-2H3
InChIKeyOFGVEDGXHAEUOW-UHFFFAOYSA-N
XLogP6.12
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500317.65
LogP ≤ 56.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-chloro-N-(4-fluoro-2-methylphenyl)pyridin-2-amine
CID 63588779
6-chloro-N-[2-methyl-5-(trifluoromethyl)phenyl]pyridin-2-amine
CID 66477569
3-[(6-chloro-2-pyridinyl)amino]-4-methylbenzonitrile
CID 55213185
6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine
CID 63585961
6-(2,5-dichloro-4-methylanilino)pyridine-2-carbonitrile
CID 104727199
6-chloro-N-(2-ethylphenyl)pyridin-2-amine
CID 63588591
6-chloro-N-(2,5-dibromophenyl)pyridin-2-amine
CID 63588218
6-bromo-N-(4-chloro-2-methoxy-5-methylphenyl)pyridin-2-amine
CID 63963848
6-chloro-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridin-2-amine
CID 63588805
6-N-(2-bromo-5-chloro-4-methylphenyl)-2-N-methylpyridine-2,6-diamine
CID 104725517
N-(5-chloro-2-methylphenyl)-6-hydrazinylpyridin-2-amine
CID 80916740
6-chloro-N-(1-methylpyrazol-3-yl)pyridin-2-amine
CID 79778392

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(4,5-dichloro-2-methylphenyl)pyridin-2-amine;ethane?
The IUPAC name of 6-chloro-N-(4,5-dichloro-2-methylphenyl)pyridin-2-amine;ethane (CID 144720384) is 6-chloro-N-(4,5-dichloro-2-methylphenyl)pyridin-2-amine;ethane.
What is the SMILES notation for 6-chloro-N-(4,5-dichloro-2-methylphenyl)pyridin-2-amine;ethane?
The canonical SMILES for 6-chloro-N-(4,5-dichloro-2-methylphenyl)pyridin-2-amine;ethane is CC.Cc1cc(Cl)c(Cl)cc1Nc1cccc(Cl)n1.
What is the InChIKey of 6-chloro-N-(4,5-dichloro-2-methylphenyl)pyridin-2-amine;ethane?
The InChIKey is OFGVEDGXHAEUOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Cl3N2.C2H6/c1-7-5-8(13)9(14)6-10(7)16-12-4-2-3-11(15)17-12;1-2/h2-6H,1H3,(H,16,17);1-2H3.
What are the key properties of 6-chloro-N-(4,5-dichloro-2-methylphenyl)pyridin-2-amine;ethane?
6-chloro-N-(4,5-dichloro-2-methylphenyl)pyridin-2-amine;ethane has a molecular weight of 317.65 g/mol, XLogP of 6.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(4,5-dichloro-2-methylphenyl)pyridin-2-amine;ethane is sourced from PubChem (CID 144720384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).