1-(1-thiophen-2-ylcyclohexyl)ethanamine

C12H19NS — CID 24860900

IUPAC1-(1-thiophen-2-ylcyclohexyl)ethanamine
SMILESCC(N)C1(c2cccs2)CCCCC1
InChIInChI=1S/C12H19NS/c1-10(13)12(7-3-2-4-8-12)11-6-5-9-14-11/h5-6,9-10H,2-4,7-8,13H2,1H3
InChIKeyOLMZNNJAFQDNIY-UHFFFAOYSA-N
MW209.36 g/mol
LogP3.30
Rot. Bonds2

About 1-(1-thiophen-2-ylcyclohexyl)ethanamine

1-(1-thiophen-2-ylcyclohexyl)ethanamine (PubChem CID 24860900) has the molecular formula C12H19NS and a molecular weight of 209.36 g/mol. Its IUPAC name is 1-(1-thiophen-2-ylcyclohexyl)ethanamine.

Molecular Properties

Compound Name1-(1-thiophen-2-ylcyclohexyl)ethanamine
PubChem CID24860900
Molecular FormulaC12H19NS
Molecular Weight209.36 g/mol
Exact Mass209.12
IUPAC Name1-(1-thiophen-2-ylcyclohexyl)ethanamine
SMILESCC(N)C1(c2cccs2)CCCCC1
InChIInChI=1S/C12H19NS/c1-10(13)12(7-3-2-4-8-12)11-6-5-9-14-11/h5-6,9-10H,2-4,7-8,13H2,1H3
InChIKeyOLMZNNJAFQDNIY-UHFFFAOYSA-N
XLogP3.30
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.36
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(Thiophen-2-yl)propan-2-amine hydrochloride
CID 12280954
1-(Thiophen-2-yl)cyclohexan-1-amine
CID 820723
[1-(Thiophen-2-yl)cyclohexyl]methanamine
CID 16494915
2-Methyl-1-thiophen-2-yl-propylamine
CID 3159240
(1-(Thiophen-2-yl)cyclopentyl)methanamine
CID 16495144
1-Thiophen-2-ylcyclohexan-1-amine;hydrochloride
CID 45259890
2-(2-Aminopropyl)thiophene
CID 6484133
1-Methyl-2-thiophen-2-yl-allylamine
CID 13583287
Phenyl(thiophen-2-yl)methanamine
CID 335613
2-(3-Fluorophenyl)-1-(thiophen-2-yl)ethan-1-amine--hydrogen chloride (1/1)
CID 3062014
2-Thenylamine, alpha-(p-fluorobenzyl)-, hydrochloride
CID 3062018
2-(3-Methylphenyl)-1-(thiophen-2-yl)ethan-1-amine--hydrogen chloride (1/1)
CID 3062026

Frequently Asked Questions

What is the IUPAC name of 1-(1-thiophen-2-ylcyclohexyl)ethanamine?
The IUPAC name of 1-(1-thiophen-2-ylcyclohexyl)ethanamine (CID 24860900) is 1-(1-thiophen-2-ylcyclohexyl)ethanamine.
What is the SMILES notation for 1-(1-thiophen-2-ylcyclohexyl)ethanamine?
The canonical SMILES for 1-(1-thiophen-2-ylcyclohexyl)ethanamine is CC(N)C1(c2cccs2)CCCCC1.
What is the InChIKey of 1-(1-thiophen-2-ylcyclohexyl)ethanamine?
The InChIKey is OLMZNNJAFQDNIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NS/c1-10(13)12(7-3-2-4-8-12)11-6-5-9-14-11/h5-6,9-10H,2-4,7-8,13H2,1H3.
What are the key properties of 1-(1-thiophen-2-ylcyclohexyl)ethanamine?
1-(1-thiophen-2-ylcyclohexyl)ethanamine has a molecular weight of 209.36 g/mol, XLogP of 3.30, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-thiophen-2-ylcyclohexyl)ethanamine is sourced from PubChem (CID 24860900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).