2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(furan-3-yl)ethanamine

C14H15ClFNO — CID 63949608

IUPAC2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(furan-3-yl)ethanamine
SMILESCCNC(Cc1ccc(F)cc1Cl)c1ccoc1
InChIInChI=1S/C14H15ClFNO/c1-2-17-14(11-5-6-18-9-11)7-10-3-4-12(16)8-13(10)15/h3-6,8-9,14,17H,2,7H2,1H3
InChIKeyUAWQRTTYVSJPMK-UHFFFAOYSA-N
MW267.73 g/mol
LogP3.97
Rot. Bonds5

About 2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(furan-3-yl)ethanamine

2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(furan-3-yl)ethanamine (PubChem CID 63949608) has the molecular formula C14H15ClFNO and a molecular weight of 267.73 g/mol. Its IUPAC name is 2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(furan-3-yl)ethanamine.

Molecular Properties

Compound Name2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(furan-3-yl)ethanamine
PubChem CID63949608
Molecular FormulaC14H15ClFNO
Molecular Weight267.73 g/mol
Exact Mass267.08
IUPAC Name2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(furan-3-yl)ethanamine
SMILESCCNC(Cc1ccc(F)cc1Cl)c1ccoc1
InChIInChI=1S/C14H15ClFNO/c1-2-17-14(11-5-6-18-9-11)7-10-3-4-12(16)8-13(10)15/h3-6,8-9,14,17H,2,7H2,1H3
InChIKeyUAWQRTTYVSJPMK-UHFFFAOYSA-N
XLogP3.97
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.73
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(5-methylfuran-3-yl)ethanamine
CID 115840534
2-(2-chloro-4-fluorophenyl)-1-(3,5-dibromophenyl)-N-ethylethanamine
CID 107974364
2-(2,3-dichlorophenyl)-N-ethyl-1-(furan-3-yl)ethanamine
CID 107308628
2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(1-propylpyrazol-4-yl)ethanamine
CID 63033873
2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(1-methylimidazol-4-yl)ethanamine
CID 107974369
2-(2-chloro-4-fluorophenyl)-1-(2-chloro-4-methylphenyl)-N-ethylethanamine
CID 106857271
2-(2-chloro-4-fluorophenyl)-1-(4-chloro-1-methylpyrazol-5-yl)-N-ethylethanamine
CID 114650423
1-(2-bromo-4-fluorophenyl)-2-(2,4-dichlorophenyl)-N-ethylethanamine
CID 115839964
2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(2-methylthiophen-3-yl)ethanamine
CID 102832366
1-(5-bromo-2-fluorophenyl)-2-(2-chloro-4-fluorophenyl)-N-ethylethanamine
CID 79723401
[2-(2,4-dichlorophenyl)-1-(furan-3-yl)ethyl]hydrazine
CID 105200228
N-ethyl-2-(4-fluorophenyl)sulfanyl-1-(furan-3-yl)ethanamine
CID 66065314

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(furan-3-yl)ethanamine?
The IUPAC name of 2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(furan-3-yl)ethanamine (CID 63949608) is 2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(furan-3-yl)ethanamine.
What is the SMILES notation for 2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(furan-3-yl)ethanamine?
The canonical SMILES for 2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(furan-3-yl)ethanamine is CCNC(Cc1ccc(F)cc1Cl)c1ccoc1.
What is the InChIKey of 2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(furan-3-yl)ethanamine?
The InChIKey is UAWQRTTYVSJPMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClFNO/c1-2-17-14(11-5-6-18-9-11)7-10-3-4-12(16)8-13(10)15/h3-6,8-9,14,17H,2,7H2,1H3.
What are the key properties of 2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(furan-3-yl)ethanamine?
2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(furan-3-yl)ethanamine has a molecular weight of 267.73 g/mol, XLogP of 3.97, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(furan-3-yl)ethanamine is sourced from PubChem (CID 63949608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).