1-(5-chlorofuran-2-yl)-2-(2,5-dichlorophenyl)ethanamine

C12H10Cl3NO — CID 106692129

IUPAC1-(5-chlorofuran-2-yl)-2-(2,5-dichlorophenyl)ethanamine
SMILESNC(Cc1cc(Cl)ccc1Cl)c1ccc(Cl)o1
InChIInChI=1S/C12H10Cl3NO/c13-8-1-2-9(14)7(5-8)6-10(16)11-3-4-12(15)17-11/h1-5,10H,6,16H2
InChIKeyALQNPKRFRVAFHD-UHFFFAOYSA-N
MW290.58 g/mol
LogP4.48
Rot. Bonds3

About 1-(5-chlorofuran-2-yl)-2-(2,5-dichlorophenyl)ethanamine

1-(5-chlorofuran-2-yl)-2-(2,5-dichlorophenyl)ethanamine (PubChem CID 106692129) has the molecular formula C12H10Cl3NO and a molecular weight of 290.58 g/mol. Its IUPAC name is 1-(5-chlorofuran-2-yl)-2-(2,5-dichlorophenyl)ethanamine.

Molecular Properties

Compound Name1-(5-chlorofuran-2-yl)-2-(2,5-dichlorophenyl)ethanamine
PubChem CID106692129
Molecular FormulaC12H10Cl3NO
Molecular Weight290.58 g/mol
Exact Mass288.98
IUPAC Name1-(5-chlorofuran-2-yl)-2-(2,5-dichlorophenyl)ethanamine
SMILESNC(Cc1cc(Cl)ccc1Cl)c1ccc(Cl)o1
InChIInChI=1S/C12H10Cl3NO/c13-8-1-2-9(14)7(5-8)6-10(16)11-3-4-12(15)17-11/h1-5,10H,6,16H2
InChIKeyALQNPKRFRVAFHD-UHFFFAOYSA-N
XLogP4.48
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.58
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-bromo-2-chlorophenyl)-1-(5-chlorofuran-2-yl)ethanamine
CID 106693067
2-(4-bromo-2-fluorophenyl)-1-(5-chlorofuran-2-yl)ethanamine
CID 106691816
1-(5-chlorofuran-2-yl)-2-(2,5-dichlorophenyl)-N-ethylethanamine
CID 106692130
1-(5-chlorofuran-2-yl)-2-(3-chlorophenyl)ethanamine
CID 106687882
1-(5-chloro-2-fluorophenyl)-2-(2,5-dichlorophenyl)ethanamine
CID 114885921
2-(2,5-dichlorophenyl)-1-(4-propan-2-ylphenyl)ethanamine
CID 65321175
1-(2,5-dichlorophenyl)-3-(2,6-dichlorophenyl)propan-2-amine
CID 65321380
2-(2,5-dichlorophenyl)-1-thiophen-2-ylethanamine
CID 65321861
1-(5-bromofuran-2-yl)-2-(2-chloro-5-fluorophenyl)ethanamine
CID 102622582
4-(2,5-dichlorophenyl)-3-methylbutan-2-amine
CID 65316880
1-(2,5-dichlorophenyl)pent-4-en-2-amine
CID 116660415
1-(2-bromo-5-methylphenyl)-2-(2,5-dichlorophenyl)ethanamine
CID 115863331

Frequently Asked Questions

What is the IUPAC name of 1-(5-chlorofuran-2-yl)-2-(2,5-dichlorophenyl)ethanamine?
The IUPAC name of 1-(5-chlorofuran-2-yl)-2-(2,5-dichlorophenyl)ethanamine (CID 106692129) is 1-(5-chlorofuran-2-yl)-2-(2,5-dichlorophenyl)ethanamine.
What is the SMILES notation for 1-(5-chlorofuran-2-yl)-2-(2,5-dichlorophenyl)ethanamine?
The canonical SMILES for 1-(5-chlorofuran-2-yl)-2-(2,5-dichlorophenyl)ethanamine is NC(Cc1cc(Cl)ccc1Cl)c1ccc(Cl)o1.
What is the InChIKey of 1-(5-chlorofuran-2-yl)-2-(2,5-dichlorophenyl)ethanamine?
The InChIKey is ALQNPKRFRVAFHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Cl3NO/c13-8-1-2-9(14)7(5-8)6-10(16)11-3-4-12(15)17-11/h1-5,10H,6,16H2.
What are the key properties of 1-(5-chlorofuran-2-yl)-2-(2,5-dichlorophenyl)ethanamine?
1-(5-chlorofuran-2-yl)-2-(2,5-dichlorophenyl)ethanamine has a molecular weight of 290.58 g/mol, XLogP of 4.48, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chlorofuran-2-yl)-2-(2,5-dichlorophenyl)ethanamine is sourced from PubChem (CID 106692129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).