1-(5-bromofuran-2-yl)-2-(4-bromophenyl)-N-ethylethanamine

C14H15Br2NO — CID 61064969

IUPAC1-(5-bromofuran-2-yl)-2-(4-bromophenyl)-N-ethylethanamine
SMILESCCNC(Cc1ccc(Br)cc1)c1ccc(Br)o1
InChIInChI=1S/C14H15Br2NO/c1-2-17-12(13-7-8-14(16)18-13)9-10-3-5-11(15)6-4-10/h3-8,12,17H,2,9H2,1H3
InChIKeyRPCKBGHFSJIKGY-UHFFFAOYSA-N
MW373.09 g/mol
LogP4.70
Rot. Bonds5

About 1-(5-bromofuran-2-yl)-2-(4-bromophenyl)-N-ethylethanamine

1-(5-bromofuran-2-yl)-2-(4-bromophenyl)-N-ethylethanamine (PubChem CID 61064969) has the molecular formula C14H15Br2NO and a molecular weight of 373.09 g/mol. Its IUPAC name is 1-(5-bromofuran-2-yl)-2-(4-bromophenyl)-N-ethylethanamine.

Molecular Properties

Compound Name1-(5-bromofuran-2-yl)-2-(4-bromophenyl)-N-ethylethanamine
PubChem CID61064969
Molecular FormulaC14H15Br2NO
Molecular Weight373.09 g/mol
Exact Mass370.95
IUPAC Name1-(5-bromofuran-2-yl)-2-(4-bromophenyl)-N-ethylethanamine
SMILESCCNC(Cc1ccc(Br)cc1)c1ccc(Br)o1
InChIInChI=1S/C14H15Br2NO/c1-2-17-12(13-7-8-14(16)18-13)9-10-3-5-11(15)6-4-10/h3-8,12,17H,2,9H2,1H3
InChIKeyRPCKBGHFSJIKGY-UHFFFAOYSA-N
XLogP4.70
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.09
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-bromofuran-2-yl)-2-(4-bromophenyl)-N-methylethanamine
CID 61066395
1-(5-bromofuran-2-yl)-2-(3,5-difluorophenyl)-N-ethylethanamine
CID 105412461
2-(3-bromo-4-fluorophenyl)-1-(5-bromofuran-2-yl)-N-ethylethanamine
CID 115818887
1-(5-bromofuran-2-yl)-N-ethyl-2-(3-methylphenyl)ethanamine
CID 55067944
1-(5-bromofuran-2-yl)-2-(3-bromo-4-methoxyphenyl)-N-ethylethanamine
CID 115818150
2-(4-bromo-2-fluorophenyl)-1-(5-bromofuran-2-yl)-N-ethylethanamine
CID 115844705
1-(5-bromofuran-2-yl)-2-(5-bromo-2-methoxyphenyl)-N-ethylethanamine
CID 115817423
N-ethyl-1-(5-ethylfuran-2-yl)-2-(4-ethylphenyl)ethanamine
CID 115803280
1-(4-bromophenyl)-N-ethylbutan-2-amine
CID 60819705
1-(3-bromofuran-2-yl)-2-(4-bromophenyl)-N-ethylethanamine
CID 63941856
1-(5-bromofuran-2-yl)-N-ethyl-2-naphthalen-1-ylethanamine
CID 63527036
1-(3-bromophenyl)-2-(4-bromophenyl)-N-ethylethanamine
CID 60819896

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromofuran-2-yl)-2-(4-bromophenyl)-N-ethylethanamine?
The IUPAC name of 1-(5-bromofuran-2-yl)-2-(4-bromophenyl)-N-ethylethanamine (CID 61064969) is 1-(5-bromofuran-2-yl)-2-(4-bromophenyl)-N-ethylethanamine.
What is the SMILES notation for 1-(5-bromofuran-2-yl)-2-(4-bromophenyl)-N-ethylethanamine?
The canonical SMILES for 1-(5-bromofuran-2-yl)-2-(4-bromophenyl)-N-ethylethanamine is CCNC(Cc1ccc(Br)cc1)c1ccc(Br)o1.
What is the InChIKey of 1-(5-bromofuran-2-yl)-2-(4-bromophenyl)-N-ethylethanamine?
The InChIKey is RPCKBGHFSJIKGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15Br2NO/c1-2-17-12(13-7-8-14(16)18-13)9-10-3-5-11(15)6-4-10/h3-8,12,17H,2,9H2,1H3.
What are the key properties of 1-(5-bromofuran-2-yl)-2-(4-bromophenyl)-N-ethylethanamine?
1-(5-bromofuran-2-yl)-2-(4-bromophenyl)-N-ethylethanamine has a molecular weight of 373.09 g/mol, XLogP of 4.70, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromofuran-2-yl)-2-(4-bromophenyl)-N-ethylethanamine is sourced from PubChem (CID 61064969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).