2-(2,4-dichlorophenyl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine

C14H15Cl2NO — CID 115839913

IUPAC2-(2,4-dichlorophenyl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine
SMILESCNC(Cc1ccc(Cl)cc1Cl)c1coc(C)c1
InChIInChI=1S/C14H15Cl2NO/c1-9-5-11(8-18-9)14(17-2)6-10-3-4-12(15)7-13(10)16/h3-5,7-8,14,17H,6H2,1-2H3
InChIKeyRMBSTQFNMBECIC-UHFFFAOYSA-N
MW284.19 g/mol
LogP4.40
Rot. Bonds4

About 2-(2,4-dichlorophenyl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine

2-(2,4-dichlorophenyl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine (PubChem CID 115839913) has the molecular formula C14H15Cl2NO and a molecular weight of 284.19 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine
PubChem CID115839913
Molecular FormulaC14H15Cl2NO
Molecular Weight284.19 g/mol
Exact Mass283.05
IUPAC Name2-(2,4-dichlorophenyl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine
SMILESCNC(Cc1ccc(Cl)cc1Cl)c1coc(C)c1
InChIInChI=1S/C14H15Cl2NO/c1-9-5-11(8-18-9)14(17-2)6-10-3-4-12(15)7-13(10)16/h3-5,7-8,14,17H,6H2,1-2H3
InChIKeyRMBSTQFNMBECIC-UHFFFAOYSA-N
XLogP4.40
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.19
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,4-dichlorophenyl)-1-(4-fluoro-3-methylphenyl)-N-methylethanamine
CID 63412888
2-(3-chlorophenyl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine
CID 114821301
2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(5-methylfuran-3-yl)ethanamine
CID 115840534
N-methyl-1-(5-methylfuran-3-yl)-2-(4-propan-2-ylphenyl)ethanamine
CID 115844127
2-(5-ethylthiophen-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine
CID 115842340
N-methyl-1-(5-methylfuran-3-yl)-2-(4-methylphenyl)ethanamine
CID 114821279
2-(2,4-dichlorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)ethanamine
CID 115840099
2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-N-methylpropan-1-amine
CID 79442168
2-(2-chloro-4-methylphenyl)-1-(3,4-dichlorophenyl)-N-methylethanamine
CID 106866146
2-(4-bromo-2-chlorophenyl)-1-(3,5-dichlorophenyl)-N-methylethanamine
CID 105037983
1-(2-bromo-5-methoxyphenyl)-2-(2,4-dichlorophenyl)-N-methylethanamine
CID 105132934
2-(4-chloro-2-fluorophenyl)-1-(4-fluoro-3-methylphenyl)-N-methylethanamine
CID 114855348

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine?
The IUPAC name of 2-(2,4-dichlorophenyl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine (CID 115839913) is 2-(2,4-dichlorophenyl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine?
The canonical SMILES for 2-(2,4-dichlorophenyl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine is CNC(Cc1ccc(Cl)cc1Cl)c1coc(C)c1.
What is the InChIKey of 2-(2,4-dichlorophenyl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine?
The InChIKey is RMBSTQFNMBECIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15Cl2NO/c1-9-5-11(8-18-9)14(17-2)6-10-3-4-12(15)7-13(10)16/h3-5,7-8,14,17H,6H2,1-2H3.
What are the key properties of 2-(2,4-dichlorophenyl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine?
2-(2,4-dichlorophenyl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine has a molecular weight of 284.19 g/mol, XLogP of 4.40, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine is sourced from PubChem (CID 115839913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).