4-(3-chloro-4-fluorophenyl)-7-(2,3-dichlorophenyl)furo[2,3-c]pyridine-2,3-diamine

C19H11Cl3FN3O — CID 118870970

IUPAC4-(3-chloro-4-fluorophenyl)-7-(2,3-dichlorophenyl)furo[2,3-c]pyridine-2,3-diamine
SMILESNc1oc2c(-c3cccc(Cl)c3Cl)ncc(-c3ccc(F)c(Cl)c3)c2c1N
InChIInChI=1S/C19H11Cl3FN3O/c20-11-3-1-2-9(15(11)22)17-18-14(16(24)19(25)27-18)10(7-26-17)8-4-5-13(23)12(21)6-8/h1-7H,24-25H2
InChIKeyDBTQJJBQAXANCO-UHFFFAOYSA-N
MW422.67 g/mol
LogP6.43
Rot. Bonds2

About 4-(3-chloro-4-fluorophenyl)-7-(2,3-dichlorophenyl)furo[2,3-c]pyridine-2,3-diamine

4-(3-chloro-4-fluorophenyl)-7-(2,3-dichlorophenyl)furo[2,3-c]pyridine-2,3-diamine (PubChem CID 118870970) has the molecular formula C19H11Cl3FN3O and a molecular weight of 422.67 g/mol. Its IUPAC name is 4-(3-chloro-4-fluorophenyl)-7-(2,3-dichlorophenyl)furo[2,3-c]pyridine-2,3-diamine.

Molecular Properties

Compound Name4-(3-chloro-4-fluorophenyl)-7-(2,3-dichlorophenyl)furo[2,3-c]pyridine-2,3-diamine
PubChem CID118870970
Molecular FormulaC19H11Cl3FN3O
Molecular Weight422.67 g/mol
Exact Mass421.00
IUPAC Name4-(3-chloro-4-fluorophenyl)-7-(2,3-dichlorophenyl)furo[2,3-c]pyridine-2,3-diamine
SMILESNc1oc2c(-c3cccc(Cl)c3Cl)ncc(-c3ccc(F)c(Cl)c3)c2c1N
InChIInChI=1S/C19H11Cl3FN3O/c20-11-3-1-2-9(15(11)22)17-18-14(16(24)19(25)27-18)10(7-26-17)8-4-5-13(23)12(21)6-8/h1-7H,24-25H2
InChIKeyDBTQJJBQAXANCO-UHFFFAOYSA-N
XLogP6.43
TPSA78.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500422.67
LogP ≤ 56.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-(3-chloro-4-fluorophenyl)-7-(2,3-dichlorophenyl)furo[2,3-c]pyridine-2,3-diamine with MolForge

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Related Compounds

4-(3-chloro-4-fluorophenyl)-7-(2,3,4-trifluorophenyl)furo[2,3-c]pyridine-2,3-diamine
CID 118870975
4-(3-chloro-4-fluorophenyl)-7-(2-ethyl-4-pyridinyl)furo[2,3-c]pyridine-2,3-diamine
CID 118871092
4-(3,4-difluorophenyl)-7-(2,6-difluoro-4-pyridinyl)furo[2,3-c]pyridine-2,3-diamine
CID 118871096
4-[4-fluoro-3-(trifluoromethyl)phenyl]-7-pyridin-4-ylfuro[2,3-c]pyridine-2,3-diamine
CID 118871049
4-(2,5-difluorophenyl)-7-(2,6-difluoro-4-pyridinyl)furo[2,3-c]pyridine-2,3-diamine
CID 118871107
2-(2,3-dichlorophenyl)-5-fluoropyridin-3-amine
CID 130088674
[7-(3-chloro-4-fluorophenyl)-1-benzofuran-2-yl]methanamine
CID 123356404
1,2-dichloro-3-[3-(difluoromethyl)-4-fluorophenyl]benzene
CID 118837736
2-(2,3-dichlorophenyl)-3-fluoropyridine
CID 118819260
5-(2,3-dichlorophenyl)pyrimidin-2-amine
CID 79022346
2-[2-amino-3-(3-chloro-4-fluorophenyl)phenyl]ethanol
CID 154291643
3-(2,3-dichlorophenyl)-4-phenyl-1,2-oxazol-5-amine
CID 43335737

Frequently Asked Questions

What is the IUPAC name of 4-(3-chloro-4-fluorophenyl)-7-(2,3-dichlorophenyl)furo[2,3-c]pyridine-2,3-diamine?
The IUPAC name of 4-(3-chloro-4-fluorophenyl)-7-(2,3-dichlorophenyl)furo[2,3-c]pyridine-2,3-diamine (CID 118870970) is 4-(3-chloro-4-fluorophenyl)-7-(2,3-dichlorophenyl)furo[2,3-c]pyridine-2,3-diamine.
What is the SMILES notation for 4-(3-chloro-4-fluorophenyl)-7-(2,3-dichlorophenyl)furo[2,3-c]pyridine-2,3-diamine?
The canonical SMILES for 4-(3-chloro-4-fluorophenyl)-7-(2,3-dichlorophenyl)furo[2,3-c]pyridine-2,3-diamine is Nc1oc2c(-c3cccc(Cl)c3Cl)ncc(-c3ccc(F)c(Cl)c3)c2c1N.
What is the InChIKey of 4-(3-chloro-4-fluorophenyl)-7-(2,3-dichlorophenyl)furo[2,3-c]pyridine-2,3-diamine?
The InChIKey is DBTQJJBQAXANCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11Cl3FN3O/c20-11-3-1-2-9(15(11)22)17-18-14(16(24)19(25)27-18)10(7-26-17)8-4-5-13(23)12(21)6-8/h1-7H,24-25H2.
What are the key properties of 4-(3-chloro-4-fluorophenyl)-7-(2,3-dichlorophenyl)furo[2,3-c]pyridine-2,3-diamine?
4-(3-chloro-4-fluorophenyl)-7-(2,3-dichlorophenyl)furo[2,3-c]pyridine-2,3-diamine has a molecular weight of 422.67 g/mol, XLogP of 6.43, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chloro-4-fluorophenyl)-7-(2,3-dichlorophenyl)furo[2,3-c]pyridine-2,3-diamine is sourced from PubChem (CID 118870970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).