N-ethyl-1-(3-ethylcyclohexyl)-2-(furan-2-yl)ethanamine

C16H27NO — CID 83176158

IUPACN-ethyl-1-(3-ethylcyclohexyl)-2-(furan-2-yl)ethanamine
SMILESCCNC(Cc1ccco1)C1CCCC(CC)C1
InChIInChI=1S/C16H27NO/c1-3-13-7-5-8-14(11-13)16(17-4-2)12-15-9-6-10-18-15/h6,9-10,13-14,16-17H,3-5,7-8,11-12H2,1-2H3
InChIKeyKUMZNNGCKYBIJD-UHFFFAOYSA-N
MW249.40 g/mol
LogP4.02
Rot. Bonds6

About N-ethyl-1-(3-ethylcyclohexyl)-2-(furan-2-yl)ethanamine

N-ethyl-1-(3-ethylcyclohexyl)-2-(furan-2-yl)ethanamine (PubChem CID 83176158) has the molecular formula C16H27NO and a molecular weight of 249.40 g/mol. Its IUPAC name is N-ethyl-1-(3-ethylcyclohexyl)-2-(furan-2-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(3-ethylcyclohexyl)-2-(furan-2-yl)ethanamine
PubChem CID83176158
Molecular FormulaC16H27NO
Molecular Weight249.40 g/mol
Exact Mass249.21
IUPAC NameN-ethyl-1-(3-ethylcyclohexyl)-2-(furan-2-yl)ethanamine
SMILESCCNC(Cc1ccco1)C1CCCC(CC)C1
InChIInChI=1S/C16H27NO/c1-3-13-7-5-8-14(11-13)16(17-4-2)12-15-9-6-10-18-15/h6,9-10,13-14,16-17H,3-5,7-8,11-12H2,1-2H3
InChIKeyKUMZNNGCKYBIJD-UHFFFAOYSA-N
XLogP4.02
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(furan-2-yl)-1-(3-methylcyclohexyl)ethyl]propan-1-amine
CID 83175112
N-ethyl-2-(furan-2-yl)-1-(2-methylcyclopentyl)ethanamine
CID 107190614
N-ethyl-1-(3-ethylcyclohexyl)-2-(4-ethylphenyl)ethanamine
CID 65414953
N-ethyl-1-(3-ethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethanamine
CID 65415760
N-ethyl-2-(furan-2-yl)-1-(5-methyloxolan-3-yl)ethanamine
CID 105029658
2-(2,3-dichlorophenyl)-N-ethyl-1-(3-ethylcyclohexyl)ethanamine
CID 107308723
3-[2-(ethylamino)-2-(3-ethylcyclohexyl)ethyl]pyridin-4-amine
CID 65413742
1-cycloheptyl-2-(furan-2-yl)-N-methylethanamine
CID 83175244
N-ethyl-1-(3-ethylcyclohexyl)-2-(4-fluoro-2-methylphenyl)ethanamine
CID 114348004
1-(2-adamantyl)-N-ethyl-2-(furan-2-yl)ethanamine
CID 105029389
N-ethyl-1-(3-ethylcyclopentyl)-2-phenylethanamine
CID 65412003
N-ethyl-1-(3-ethylcyclopentyl)-2-(furan-3-yl)ethanamine
CID 83175352

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(3-ethylcyclohexyl)-2-(furan-2-yl)ethanamine?
The IUPAC name of N-ethyl-1-(3-ethylcyclohexyl)-2-(furan-2-yl)ethanamine (CID 83176158) is N-ethyl-1-(3-ethylcyclohexyl)-2-(furan-2-yl)ethanamine.
What is the SMILES notation for N-ethyl-1-(3-ethylcyclohexyl)-2-(furan-2-yl)ethanamine?
The canonical SMILES for N-ethyl-1-(3-ethylcyclohexyl)-2-(furan-2-yl)ethanamine is CCNC(Cc1ccco1)C1CCCC(CC)C1.
What is the InChIKey of N-ethyl-1-(3-ethylcyclohexyl)-2-(furan-2-yl)ethanamine?
The InChIKey is KUMZNNGCKYBIJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO/c1-3-13-7-5-8-14(11-13)16(17-4-2)12-15-9-6-10-18-15/h6,9-10,13-14,16-17H,3-5,7-8,11-12H2,1-2H3.
What are the key properties of N-ethyl-1-(3-ethylcyclohexyl)-2-(furan-2-yl)ethanamine?
N-ethyl-1-(3-ethylcyclohexyl)-2-(furan-2-yl)ethanamine has a molecular weight of 249.40 g/mol, XLogP of 4.02, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(3-ethylcyclohexyl)-2-(furan-2-yl)ethanamine is sourced from PubChem (CID 83176158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).