N-ethyl-1-(3-ethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethanamine

C18H31NS — CID 65415760

IUPACN-ethyl-1-(3-ethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethanamine
SMILESCCNC(Cc1ccc(CC)s1)C1CCCC(CC)C1
InChIInChI=1S/C18H31NS/c1-4-14-8-7-9-15(12-14)18(19-6-3)13-17-11-10-16(5-2)20-17/h10-11,14-15,18-19H,4-9,12-13H2,1-3H3
InChIKeyNOWMTZSRAUFPFL-UHFFFAOYSA-N
MW293.52 g/mol
LogP5.05
Rot. Bonds7

About N-ethyl-1-(3-ethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethanamine

N-ethyl-1-(3-ethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethanamine (PubChem CID 65415760) has the molecular formula C18H31NS and a molecular weight of 293.52 g/mol. Its IUPAC name is N-ethyl-1-(3-ethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(3-ethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethanamine
PubChem CID65415760
Molecular FormulaC18H31NS
Molecular Weight293.52 g/mol
Exact Mass293.22
IUPAC NameN-ethyl-1-(3-ethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethanamine
SMILESCCNC(Cc1ccc(CC)s1)C1CCCC(CC)C1
InChIInChI=1S/C18H31NS/c1-4-14-8-7-9-15(12-14)18(19-6-3)13-17-11-10-16(5-2)20-17/h10-11,14-15,18-19H,4-9,12-13H2,1-3H3
InChIKeyNOWMTZSRAUFPFL-UHFFFAOYSA-N
XLogP5.05
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500293.52
LogP ≤ 55.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-(3-ethylcyclohexyl)-2-(4-ethylphenyl)ethanamine
CID 65414953
N-ethyl-2-(5-ethylthiophen-2-yl)-1-(4-propan-2-ylcyclohexyl)ethanamine
CID 65423043
N-ethyl-1-(3-ethylcyclohexyl)-2-(furan-2-yl)ethanamine
CID 83176158
N-ethyl-1-(3-ethylcyclohexyl)-2-(4-fluoro-2-methylphenyl)ethanamine
CID 114348004
2-(2,3-dichlorophenyl)-N-ethyl-1-(3-ethylcyclohexyl)ethanamine
CID 107308723
N-[1-(4-ethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethyl]propan-1-amine
CID 65392917
N-ethyl-2-(5-ethylthiophen-2-yl)-1-(5-methyloxolan-3-yl)ethanamine
CID 115842776
3-[2-(ethylamino)-2-(3-ethylcyclohexyl)ethyl]pyridin-4-amine
CID 65413742
N-[1-cyclohexyl-2-(5-ethylthiophen-2-yl)ethyl]propan-1-amine
CID 63413397
N-[1-cyclopropyl-2-(5-ethylthiophen-2-yl)ethyl]propan-1-amine
CID 62600030
N-ethyl-1-(3-ethylcyclohexyl)-2-(1-methylpyrazol-4-yl)ethanamine
CID 65413948
N-ethyl-1-(3-ethylcyclohexyl)-2-(4-fluorophenyl)sulfanylethanamine
CID 66066110

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(3-ethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethanamine?
The IUPAC name of N-ethyl-1-(3-ethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethanamine (CID 65415760) is N-ethyl-1-(3-ethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethanamine.
What is the SMILES notation for N-ethyl-1-(3-ethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethanamine?
The canonical SMILES for N-ethyl-1-(3-ethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethanamine is CCNC(Cc1ccc(CC)s1)C1CCCC(CC)C1.
What is the InChIKey of N-ethyl-1-(3-ethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethanamine?
The InChIKey is NOWMTZSRAUFPFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31NS/c1-4-14-8-7-9-15(12-14)18(19-6-3)13-17-11-10-16(5-2)20-17/h10-11,14-15,18-19H,4-9,12-13H2,1-3H3.
What are the key properties of N-ethyl-1-(3-ethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethanamine?
N-ethyl-1-(3-ethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethanamine has a molecular weight of 293.52 g/mol, XLogP of 5.05, 7 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-(5-ethylthiophen-2-yl)ethanamine is sourced from PubChem (CID 65415760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).