N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-2-ylethanamine

C16H27NS — CID 63861481

IUPACN-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-2-ylethanamine
SMILESCCNC(Cc1cccs1)C1CCCCC1CC
InChIInChI=1S/C16H27NS/c1-3-13-8-5-6-10-15(13)16(17-4-2)12-14-9-7-11-18-14/h7,9,11,13,15-17H,3-6,8,10,12H2,1-2H3
InChIKeyZTHDREJHIQBPGK-UHFFFAOYSA-N
MW265.47 g/mol
LogP4.49
Rot. Bonds6

About N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-2-ylethanamine

N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-2-ylethanamine (PubChem CID 63861481) has the molecular formula C16H27NS and a molecular weight of 265.47 g/mol. Its IUPAC name is N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-2-ylethanamine.

Molecular Properties

Compound NameN-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-2-ylethanamine
PubChem CID63861481
Molecular FormulaC16H27NS
Molecular Weight265.47 g/mol
Exact Mass265.19
IUPAC NameN-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-2-ylethanamine
SMILESCCNC(Cc1cccs1)C1CCCCC1CC
InChIInChI=1S/C16H27NS/c1-3-13-8-5-6-10-15(13)16(17-4-2)12-14-9-7-11-18-14/h7,9,11,13,15-17H,3-6,8,10,12H2,1-2H3
InChIKeyZTHDREJHIQBPGK-UHFFFAOYSA-N
XLogP4.49
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.47
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-ethylcyclohexyl)-N-methyl-2-thiophen-2-ylethanamine
CID 63861480
1-cyclopentyl-N-ethyl-2-thiophen-2-ylethanamine
CID 61065338
N-ethyl-1-(2-methylcyclopentyl)-2-thiophen-2-ylethanamine
CID 107179496
1-(2-ethylcyclohexyl)-2-thiophen-2-ylethanamine
CID 63861303
N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine
CID 105151151
N-ethyl-1-(5-methyloxolan-2-yl)-2-thiophen-2-ylethanamine
CID 115840777
1-(4,4-dimethylcyclohexyl)-N-ethyl-2-thiophen-2-ylethanamine
CID 65389654
N-(1-cyclopentyl-2-thiophen-2-ylethyl)propan-1-amine
CID 61064990
N-(1-cyclohexyl-2-thiophen-2-ylethyl)propan-1-amine
CID 61066233
N-ethyl-1-(2-ethylcyclohexyl)-2-phenoxyethanamine
CID 63862380
N-ethyl-1-(2-ethylcyclohexyl)-2-pyridin-3-ylethanamine
CID 63861666
N-ethyl-1-(5-oxaspiro[3.5]nonan-8-yl)-2-thiophen-2-ylethanamine
CID 79914388

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-2-ylethanamine?
The IUPAC name of N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-2-ylethanamine (CID 63861481) is N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-2-ylethanamine.
What is the SMILES notation for N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-2-ylethanamine?
The canonical SMILES for N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-2-ylethanamine is CCNC(Cc1cccs1)C1CCCCC1CC.
What is the InChIKey of N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-2-ylethanamine?
The InChIKey is ZTHDREJHIQBPGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NS/c1-3-13-8-5-6-10-15(13)16(17-4-2)12-14-9-7-11-18-14/h7,9,11,13,15-17H,3-6,8,10,12H2,1-2H3.
What are the key properties of N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-2-ylethanamine?
N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-2-ylethanamine has a molecular weight of 265.47 g/mol, XLogP of 4.49, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-2-ylethanamine is sourced from PubChem (CID 63861481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).