2-N-(4-chlorophenyl)-6-N-methylpyrazine-2,6-diamine

C11H11ClN4 — CID 80760465

IUPAC2-N-(4-chlorophenyl)-6-N-methylpyrazine-2,6-diamine
SMILESCNc1cncc(Nc2ccc(Cl)cc2)n1
InChIInChI=1S/C11H11ClN4/c1-13-10-6-14-7-11(16-10)15-9-4-2-8(12)3-5-9/h2-7H,1H3,(H2,13,15,16)
InChIKeyYKSFJGPXKNZGHK-UHFFFAOYSA-N
MW234.69 g/mol
LogP2.92
Rot. Bonds3

About 2-N-(4-chlorophenyl)-6-N-methylpyrazine-2,6-diamine

2-N-(4-chlorophenyl)-6-N-methylpyrazine-2,6-diamine (PubChem CID 80760465) has the molecular formula C11H11ClN4 and a molecular weight of 234.69 g/mol. Its IUPAC name is 2-N-(4-chlorophenyl)-6-N-methylpyrazine-2,6-diamine.

Molecular Properties

Compound Name2-N-(4-chlorophenyl)-6-N-methylpyrazine-2,6-diamine
PubChem CID80760465
Molecular FormulaC11H11ClN4
Molecular Weight234.69 g/mol
Exact Mass234.07
IUPAC Name2-N-(4-chlorophenyl)-6-N-methylpyrazine-2,6-diamine
SMILESCNc1cncc(Nc2ccc(Cl)cc2)n1
InChIInChI=1S/C11H11ClN4/c1-13-10-6-14-7-11(16-10)15-9-4-2-8(12)3-5-9/h2-7H,1H3,(H2,13,15,16)
InChIKeyYKSFJGPXKNZGHK-UHFFFAOYSA-N
XLogP2.92
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.69
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-(5-chloro-2-methylphenyl)-6-N-methylpyrazine-2,6-diamine
CID 80755142
6-N-methyl-2-N-(3-methylphenyl)pyrazine-2,6-diamine
CID 80755462
N-(4-chlorophenyl)-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine
CID 25230411
N-(4-chlorophenyl)-6-pyridin-2-ylpyrazin-2-amine
CID 25230480
6-N-methyl-2-N-(2,4,5-trichlorophenyl)pyrazine-2,6-diamine
CID 80759464
6-chloro-N-methylpyrazin-2-amine
CID 26967011
2-N-[4-bromo-3-(trifluoromethyl)phenyl]-6-N-methylpyrazine-2,6-diamine
CID 80840633
2-N-(2,6-dichloro-4-fluorophenyl)-6-N-methylpyrazine-2,6-diamine
CID 83082157
6-(3,5-dichlorophenyl)-N-methylpyrazin-2-amine
CID 114879324
6-N-methyl-2-N-(2,3,4,5,6-pentafluorophenyl)pyrazine-2,6-diamine
CID 115565279
2-N-(3-chloro-4-fluorophenyl)-6-N-propylpyrazine-2,6-diamine
CID 80755290
6-[(5-chloro-2-pyridinyl)sulfanyl]-N-methylpyrazin-2-amine
CID 80891522

Frequently Asked Questions

What is the IUPAC name of 2-N-(4-chlorophenyl)-6-N-methylpyrazine-2,6-diamine?
The IUPAC name of 2-N-(4-chlorophenyl)-6-N-methylpyrazine-2,6-diamine (CID 80760465) is 2-N-(4-chlorophenyl)-6-N-methylpyrazine-2,6-diamine.
What is the SMILES notation for 2-N-(4-chlorophenyl)-6-N-methylpyrazine-2,6-diamine?
The canonical SMILES for 2-N-(4-chlorophenyl)-6-N-methylpyrazine-2,6-diamine is CNc1cncc(Nc2ccc(Cl)cc2)n1.
What is the InChIKey of 2-N-(4-chlorophenyl)-6-N-methylpyrazine-2,6-diamine?
The InChIKey is YKSFJGPXKNZGHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN4/c1-13-10-6-14-7-11(16-10)15-9-4-2-8(12)3-5-9/h2-7H,1H3,(H2,13,15,16).
What are the key properties of 2-N-(4-chlorophenyl)-6-N-methylpyrazine-2,6-diamine?
2-N-(4-chlorophenyl)-6-N-methylpyrazine-2,6-diamine has a molecular weight of 234.69 g/mol, XLogP of 2.92, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(4-chlorophenyl)-6-N-methylpyrazine-2,6-diamine is sourced from PubChem (CID 80760465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).