N-ethyl-1-(5-ethylfuran-2-yl)-2-(4-ethylphenyl)ethanamine

C18H25NO — CID 115803280

IUPACN-ethyl-1-(5-ethylfuran-2-yl)-2-(4-ethylphenyl)ethanamine
SMILESCCNC(Cc1ccc(CC)cc1)c1ccc(CC)o1
InChIInChI=1S/C18H25NO/c1-4-14-7-9-15(10-8-14)13-17(19-6-3)18-12-11-16(5-2)20-18/h7-12,17,19H,4-6,13H2,1-3H3
InChIKeyKQKMBTXECCCVDL-UHFFFAOYSA-N
MW271.40 g/mol
LogP4.30
Rot. Bonds7

About N-ethyl-1-(5-ethylfuran-2-yl)-2-(4-ethylphenyl)ethanamine

N-ethyl-1-(5-ethylfuran-2-yl)-2-(4-ethylphenyl)ethanamine (PubChem CID 115803280) has the molecular formula C18H25NO and a molecular weight of 271.40 g/mol. Its IUPAC name is N-ethyl-1-(5-ethylfuran-2-yl)-2-(4-ethylphenyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(5-ethylfuran-2-yl)-2-(4-ethylphenyl)ethanamine
PubChem CID115803280
Molecular FormulaC18H25NO
Molecular Weight271.40 g/mol
Exact Mass271.19
IUPAC NameN-ethyl-1-(5-ethylfuran-2-yl)-2-(4-ethylphenyl)ethanamine
SMILESCCNC(Cc1ccc(CC)cc1)c1ccc(CC)o1
InChIInChI=1S/C18H25NO/c1-4-14-7-9-15(10-8-14)13-17(19-6-3)18-12-11-16(5-2)20-18/h7-12,17,19H,4-6,13H2,1-3H3
InChIKeyKQKMBTXECCCVDL-UHFFFAOYSA-N
XLogP4.30
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-(5-ethylfuran-2-yl)-2-(furan-3-yl)ethanamine
CID 105029929
N-ethyl-1-(5-ethylfuran-2-yl)-2-(3-fluoro-4-methoxyphenyl)ethanamine
CID 115829659
N-ethyl-1-(5-ethylfuran-2-yl)-3-methylbut-3-en-1-amine
CID 105004038
N-ethyl-1-(5-ethylfuran-2-yl)hexan-1-amine
CID 62346766
1-(5-bromofuran-2-yl)-2-(4-bromophenyl)-N-ethylethanamine
CID 61064969
N-ethyl-1-(5-ethylfuran-2-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethanamine
CID 104997720
N-ethyl-1-(5-ethylfuran-2-yl)-2-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 104997064
N,3-diethyl-1-(5-ethylfuran-2-yl)heptan-1-amine
CID 115806207
N-ethyl-1-(5-ethylfuran-2-yl)-4-methoxybutan-1-amine
CID 105054918
2-cyclobutyl-N-ethyl-1-(5-ethylfuran-2-yl)ethanamine
CID 115863601
N-[1-(5-chlorofuran-2-yl)-2-(4-ethylphenyl)ethyl]propan-1-amine
CID 106691522
2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-N-ethyl-1-(5-ethylfuran-2-yl)ethanamine
CID 104998451

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(5-ethylfuran-2-yl)-2-(4-ethylphenyl)ethanamine?
The IUPAC name of N-ethyl-1-(5-ethylfuran-2-yl)-2-(4-ethylphenyl)ethanamine (CID 115803280) is N-ethyl-1-(5-ethylfuran-2-yl)-2-(4-ethylphenyl)ethanamine.
What is the SMILES notation for N-ethyl-1-(5-ethylfuran-2-yl)-2-(4-ethylphenyl)ethanamine?
The canonical SMILES for N-ethyl-1-(5-ethylfuran-2-yl)-2-(4-ethylphenyl)ethanamine is CCNC(Cc1ccc(CC)cc1)c1ccc(CC)o1.
What is the InChIKey of N-ethyl-1-(5-ethylfuran-2-yl)-2-(4-ethylphenyl)ethanamine?
The InChIKey is KQKMBTXECCCVDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25NO/c1-4-14-7-9-15(10-8-14)13-17(19-6-3)18-12-11-16(5-2)20-18/h7-12,17,19H,4-6,13H2,1-3H3.
What are the key properties of N-ethyl-1-(5-ethylfuran-2-yl)-2-(4-ethylphenyl)ethanamine?
N-ethyl-1-(5-ethylfuran-2-yl)-2-(4-ethylphenyl)ethanamine has a molecular weight of 271.40 g/mol, XLogP of 4.30, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(5-ethylfuran-2-yl)-2-(4-ethylphenyl)ethanamine is sourced from PubChem (CID 115803280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).