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

C14H23NS — CID 105151200

IUPAC1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine
SMILESCCC1CCCCC1C(N)Cc1ccsc1
InChIInChI=1S/C14H23NS/c1-2-12-5-3-4-6-13(12)14(15)9-11-7-8-16-10-11/h7-8,10,12-14H,2-6,9,15H2,1H3
InChIKeyAVOPZBIAXGUMGS-UHFFFAOYSA-N
MW237.41 g/mol
LogP3.83
Rot. Bonds4

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

1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine (PubChem CID 105151200) has the molecular formula C14H23NS and a molecular weight of 237.41 g/mol. Its IUPAC name is 1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine.

Molecular Properties

Compound Name1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine
PubChem CID105151200
Molecular FormulaC14H23NS
Molecular Weight237.41 g/mol
Exact Mass237.16
IUPAC Name1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine
SMILESCCC1CCCCC1C(N)Cc1ccsc1
InChIInChI=1S/C14H23NS/c1-2-12-5-3-4-6-13(12)14(15)9-11-7-8-16-10-11/h7-8,10,12-14H,2-6,9,15H2,1H3
InChIKeyAVOPZBIAXGUMGS-UHFFFAOYSA-N
XLogP3.83
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.41
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine
CID 105151151
N-[1-(2-ethylcyclohexyl)-2-thiophen-3-ylethyl]propan-1-amine
CID 105151192
1-(2-ethylcyclohexyl)-2-phenylethanamine
CID 63862721
1-(2-ethylcyclohexyl)-2-thiophen-2-ylethanamine
CID 63861303
2-(3,5-difluorophenyl)-1-(2-ethylcyclohexyl)ethanamine
CID 63862912
1-(2-ethylcyclohexyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
CID 55252390
3-cyclopropyl-1-thiophen-3-ylbutan-2-amine
CID 83155210
1-(oxolan-2-yl)-2-thiophen-3-ylethanamine
CID 61080120
N-[[2-(thiophen-3-ylmethyl)cyclohexyl]methyl]propan-2-amine
CID 81024765
1-(2-ethylcyclohexyl)-3-methylbutan-1-amine
CID 63863455
N-[1-(thian-2-yl)-2-thiophen-3-ylethyl]propan-1-amine
CID 80626191
1-(thian-2-yl)-3-thiophen-3-ylpropan-1-amine
CID 80626558

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine?
The IUPAC name of 1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine (CID 105151200) is 1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine.
What is the SMILES notation for 1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine?
The canonical SMILES for 1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine is CCC1CCCCC1C(N)Cc1ccsc1.
What is the InChIKey of 1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine?
The InChIKey is AVOPZBIAXGUMGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NS/c1-2-12-5-3-4-6-13(12)14(15)9-11-7-8-16-10-11/h7-8,10,12-14H,2-6,9,15H2,1H3.
What are the key properties of 1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine?
1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine has a molecular weight of 237.41 g/mol, XLogP of 3.83, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylcyclohexyl)-2-thiophen-3-ylethanamine is sourced from PubChem (CID 105151200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).