N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine

C16H27NS — CID 105151151

IUPACN-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine
SMILESCCNC(Cc1ccsc1)C1CCCCC1CC
InChIInChI=1S/C16H27NS/c1-3-14-7-5-6-8-15(14)16(17-4-2)11-13-9-10-18-12-13/h9-10,12,14-17H,3-8,11H2,1-2H3
InChIKeyJPZRHUHJVQGNOO-UHFFFAOYSA-N
MW265.47 g/mol
LogP4.49
Rot. Bonds6

About N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine

N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine (PubChem CID 105151151) 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-3-ylethanamine.

Molecular Properties

Compound NameN-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine
PubChem CID105151151
Molecular FormulaC16H27NS
Molecular Weight265.47 g/mol
Exact Mass265.19
IUPAC NameN-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine
SMILESCCNC(Cc1ccsc1)C1CCCCC1CC
InChIInChI=1S/C16H27NS/c1-3-14-7-5-6-8-15(14)16(17-4-2)11-13-9-10-18-12-13/h9-10,12,14-17H,3-8,11H2,1-2H3
InChIKeyJPZRHUHJVQGNOO-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

N-[1-(2-ethylcyclohexyl)-2-thiophen-3-ylethyl]propan-1-amine
CID 105151192
1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine
CID 105151200
N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-2-ylethanamine
CID 63861481
N-ethyl-1-(2-ethylcyclohexyl)-2-pyridin-3-ylethanamine
CID 63861666
N-ethyl-1-(3-ethyl-1,4-dithian-2-yl)-2-thiophen-3-ylethanamine
CID 113299739
1-(2-adamantyl)-N-ethyl-2-thiophen-3-ylethanamine
CID 81098396
1-(2,3-dihydro-1-benzothiophen-3-yl)-N-ethyl-2-thiophen-3-ylethanamine
CID 105137509
N-ethyl-1-(6-oxaspiro[4.5]decan-9-yl)-2-thiophen-3-ylethanamine
CID 105170153
N-ethyl-1-(2-ethylcyclohexyl)-2-phenoxyethanamine
CID 63862380
N-[1-(thian-2-yl)-2-thiophen-3-ylethyl]propan-1-amine
CID 80626191
N-ethyl-1-(thian-2-yl)-3-thiophen-3-ylpropan-1-amine
CID 80626936
N-methyl-1-(4-propan-2-ylcyclohexyl)-2-thiophen-3-ylethanamine
CID 65423218

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine?
The IUPAC name of N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine (CID 105151151) is N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine.
What is the SMILES notation for N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine?
The canonical SMILES for N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine is CCNC(Cc1ccsc1)C1CCCCC1CC.
What is the InChIKey of N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine?
The InChIKey is JPZRHUHJVQGNOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NS/c1-3-14-7-5-6-8-15(14)16(17-4-2)11-13-9-10-18-12-13/h9-10,12,14-17H,3-8,11H2,1-2H3.
What are the key properties of N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine?
N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-3-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-3-ylethanamine is sourced from PubChem (CID 105151151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).