3-(2,3-dichlorophenyl)-6-N-(2-ethoxyethyl)pyrazine-2,6-diamine

C14H16Cl2N4O — CID 144867888

IUPAC3-(2,3-dichlorophenyl)-6-N-(2-ethoxyethyl)pyrazine-2,6-diamine
SMILESCCOCCNc1cnc(-c2cccc(Cl)c2Cl)c(N)n1
InChIInChI=1S/C14H16Cl2N4O/c1-2-21-7-6-18-11-8-19-13(14(17)20-11)9-4-3-5-10(15)12(9)16/h3-5,8H,2,6-7H2,1H3,(H3,17,18,20)
InChIKeyCWSTWBPDMWISHN-UHFFFAOYSA-N
MW327.22 g/mol
LogP3.48
Rot. Bonds6

About 3-(2,3-dichlorophenyl)-6-N-(2-ethoxyethyl)pyrazine-2,6-diamine

3-(2,3-dichlorophenyl)-6-N-(2-ethoxyethyl)pyrazine-2,6-diamine (PubChem CID 144867888) has the molecular formula C14H16Cl2N4O and a molecular weight of 327.22 g/mol. Its IUPAC name is 3-(2,3-dichlorophenyl)-6-N-(2-ethoxyethyl)pyrazine-2,6-diamine.

Molecular Properties

Compound Name3-(2,3-dichlorophenyl)-6-N-(2-ethoxyethyl)pyrazine-2,6-diamine
PubChem CID144867888
Molecular FormulaC14H16Cl2N4O
Molecular Weight327.22 g/mol
Exact Mass326.07
IUPAC Name3-(2,3-dichlorophenyl)-6-N-(2-ethoxyethyl)pyrazine-2,6-diamine
SMILESCCOCCNc1cnc(-c2cccc(Cl)c2Cl)c(N)n1
InChIInChI=1S/C14H16Cl2N4O/c1-2-21-7-6-18-11-8-19-13(14(17)20-11)9-4-3-5-10(15)12(9)16/h3-5,8H,2,6-7H2,1H3,(H3,17,18,20)
InChIKeyCWSTWBPDMWISHN-UHFFFAOYSA-N
XLogP3.48
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.22
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 3-(2,3-dichlorophenyl)-6-N-(2-ethoxyethyl)pyrazine-2,6-diamine 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

2-[2-[[5-amino-6-(2,3-dichlorophenyl)-1,2,4-triazin-3-yl]amino]ethoxy]ethyl methyl carbonate
CID 118166347
3-(2,3-dichlorophenyl)-6-[4-(ethylamino)-4-methylpiperidin-1-yl]pyrazin-2-amine
CID 167296773
5-(2,3-dichlorophenyl)-6-methylpyrazin-2-amine
CID 142143814
6-[(4-amino-4-methylpiperidin-1-yl)methyl]-3-(2,3-dichlorophenyl)pyrazin-2-amine
CID 167432571
2-[[6-amino-3-bromo-5-(2,3-dichlorophenyl)pyrazin-2-yl]amino]ethyl carbamate
CID 175443022
4-N-(2-ethoxyethyl)pyrimidine-2,4-diamine
CID 80792890
6-ethoxy-2-N-(2-ethoxyethyl)pyridine-2,5-diamine
CID 43591109
6-bromo-N-(2-ethoxyethyl)pyridin-2-amine
CID 63962795
3-(2,3-dichlorophenyl)-6-(5-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)pyrazin-2-amine;methane
CID 142543281
6-(4,9-diazadispiro[2.1.25.33]decan-9-yl)-3-(2,3-dichlorophenyl)pyrazin-2-amine
CID 163880923
6-[(3aR)-5-(aminomethyl)-5-methyl-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrol-2-yl]-3-(2,3-dichlorophenyl)pyrazin-2-amine
CID 138466405
3-chloro-N-(2-ethoxyethyl)-2-fluoroaniline
CID 43387895

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dichlorophenyl)-6-N-(2-ethoxyethyl)pyrazine-2,6-diamine?
The IUPAC name of 3-(2,3-dichlorophenyl)-6-N-(2-ethoxyethyl)pyrazine-2,6-diamine (CID 144867888) is 3-(2,3-dichlorophenyl)-6-N-(2-ethoxyethyl)pyrazine-2,6-diamine.
What is the SMILES notation for 3-(2,3-dichlorophenyl)-6-N-(2-ethoxyethyl)pyrazine-2,6-diamine?
The canonical SMILES for 3-(2,3-dichlorophenyl)-6-N-(2-ethoxyethyl)pyrazine-2,6-diamine is CCOCCNc1cnc(-c2cccc(Cl)c2Cl)c(N)n1.
What is the InChIKey of 3-(2,3-dichlorophenyl)-6-N-(2-ethoxyethyl)pyrazine-2,6-diamine?
The InChIKey is CWSTWBPDMWISHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16Cl2N4O/c1-2-21-7-6-18-11-8-19-13(14(17)20-11)9-4-3-5-10(15)12(9)16/h3-5,8H,2,6-7H2,1H3,(H3,17,18,20).
What are the key properties of 3-(2,3-dichlorophenyl)-6-N-(2-ethoxyethyl)pyrazine-2,6-diamine?
3-(2,3-dichlorophenyl)-6-N-(2-ethoxyethyl)pyrazine-2,6-diamine has a molecular weight of 327.22 g/mol, XLogP of 3.48, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dichlorophenyl)-6-N-(2-ethoxyethyl)pyrazine-2,6-diamine is sourced from PubChem (CID 144867888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).