cyclohexen-1-yl(thiophen-2-yl)methanamine

C11H15NS — CID 62078485

IUPACcyclohexen-1-yl(thiophen-2-yl)methanamine
SMILESNC(C1=CCCCC1)c1cccs1
InChIInChI=1S/C11H15NS/c12-11(10-7-4-8-13-10)9-5-2-1-3-6-9/h4-5,7-8,11H,1-3,6,12H2
InChIKeyNVURPUVHMUAQAW-UHFFFAOYSA-N
MW193.32 g/mol
LogP3.25
Rot. Bonds2

About cyclohexen-1-yl(thiophen-2-yl)methanamine

cyclohexen-1-yl(thiophen-2-yl)methanamine (PubChem CID 62078485) has the molecular formula C11H15NS and a molecular weight of 193.32 g/mol. Its IUPAC name is cyclohexen-1-yl(thiophen-2-yl)methanamine.

Molecular Properties

Compound Namecyclohexen-1-yl(thiophen-2-yl)methanamine
PubChem CID62078485
Molecular FormulaC11H15NS
Molecular Weight193.32 g/mol
Exact Mass193.09
IUPAC Namecyclohexen-1-yl(thiophen-2-yl)methanamine
SMILESNC(C1=CCCCC1)c1cccs1
InChIInChI=1S/C11H15NS/c12-11(10-7-4-8-13-10)9-5-2-1-3-6-9/h4-5,7-8,11H,1-3,6,12H2
InChIKeyNVURPUVHMUAQAW-UHFFFAOYSA-N
XLogP3.25
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.32
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

cyclohepten-1-yl(thiophen-2-yl)methanol
CID 62077908
cyclohepten-1-yl(thieno[3,2-b]thiophen-5-yl)methanamine
CID 80733888
(4-bromothiophen-2-yl)-(cyclohexen-1-yl)methanamine
CID 106653049
(4-bromothiophen-2-yl)-(cycloocten-1-yl)methanamine
CID 106653050
dithiophen-2-ylmethanamine;hydroiodide
CID 175262247
N-[cyclohepten-1-yl(thiophen-2-yl)methyl]propan-1-amine
CID 62080201
[(1E)-cycloocten-1-yl]-(5-ethylthiophen-2-yl)methanamine
CID 106656355
1-[(1E)-cycloocten-1-yl]-2-thiophen-2-ylethanol
CID 106657625
[(1E)-cycloocten-1-yl]-(2-fluorophenyl)methanamine
CID 106652892
[1-[(1E)-cycloocten-1-yl]-4-thiophen-2-ylbutyl]hydrazine
CID 106650086
2,3-dihydrofuran-5-yl(thiophen-2-yl)methanamine
CID 102651186
[(1E)-cycloocten-1-yl]-(4-methylphenyl)methanamine
CID 106652452

Frequently Asked Questions

What is the IUPAC name of cyclohexen-1-yl(thiophen-2-yl)methanamine?
The IUPAC name of cyclohexen-1-yl(thiophen-2-yl)methanamine (CID 62078485) is cyclohexen-1-yl(thiophen-2-yl)methanamine.
What is the SMILES notation for cyclohexen-1-yl(thiophen-2-yl)methanamine?
The canonical SMILES for cyclohexen-1-yl(thiophen-2-yl)methanamine is NC(C1=CCCCC1)c1cccs1.
What is the InChIKey of cyclohexen-1-yl(thiophen-2-yl)methanamine?
The InChIKey is NVURPUVHMUAQAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NS/c12-11(10-7-4-8-13-10)9-5-2-1-3-6-9/h4-5,7-8,11H,1-3,6,12H2.
What are the key properties of cyclohexen-1-yl(thiophen-2-yl)methanamine?
cyclohexen-1-yl(thiophen-2-yl)methanamine has a molecular weight of 193.32 g/mol, XLogP of 3.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexen-1-yl(thiophen-2-yl)methanamine is sourced from PubChem (CID 62078485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).