N-ethyl-N-(2-thiophen-2-ylethyl)cyclohexanamine

C14H23NS — CID 150257047

IUPACN-ethyl-N-(2-thiophen-2-ylethyl)cyclohexanamine
SMILESCCN(CCc1cccs1)C1CCCCC1
InChIInChI=1S/C14H23NS/c1-2-15(13-7-4-3-5-8-13)11-10-14-9-6-12-16-14/h6,9,12-13H,2-5,7-8,10-11H2,1H3
InChIKeyGATUDDXUZIVBQV-UHFFFAOYSA-N
MW237.41 g/mol
LogP3.95
Rot. Bonds5

About N-ethyl-N-(2-thiophen-2-ylethyl)cyclohexanamine

N-ethyl-N-(2-thiophen-2-ylethyl)cyclohexanamine (PubChem CID 150257047) has the molecular formula C14H23NS and a molecular weight of 237.41 g/mol. Its IUPAC name is N-ethyl-N-(2-thiophen-2-ylethyl)cyclohexanamine.

Molecular Properties

Compound NameN-ethyl-N-(2-thiophen-2-ylethyl)cyclohexanamine
PubChem CID150257047
Molecular FormulaC14H23NS
Molecular Weight237.41 g/mol
Exact Mass237.16
IUPAC NameN-ethyl-N-(2-thiophen-2-ylethyl)cyclohexanamine
SMILESCCN(CCc1cccs1)C1CCCCC1
InChIInChI=1S/C14H23NS/c1-2-15(13-7-4-3-5-8-13)11-10-14-9-6-12-16-14/h6,9,12-13H,2-5,7-8,10-11H2,1H3
InChIKeyGATUDDXUZIVBQV-UHFFFAOYSA-N
XLogP3.95
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.41
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-thiophen-2-ylethyl)cyclohexanamine?
The IUPAC name of N-ethyl-N-(2-thiophen-2-ylethyl)cyclohexanamine (CID 150257047) is N-ethyl-N-(2-thiophen-2-ylethyl)cyclohexanamine.
What is the SMILES notation for N-ethyl-N-(2-thiophen-2-ylethyl)cyclohexanamine?
The canonical SMILES for N-ethyl-N-(2-thiophen-2-ylethyl)cyclohexanamine is CCN(CCc1cccs1)C1CCCCC1.
What is the InChIKey of N-ethyl-N-(2-thiophen-2-ylethyl)cyclohexanamine?
The InChIKey is GATUDDXUZIVBQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NS/c1-2-15(13-7-4-3-5-8-13)11-10-14-9-6-12-16-14/h6,9,12-13H,2-5,7-8,10-11H2,1H3.
What are the key properties of N-ethyl-N-(2-thiophen-2-ylethyl)cyclohexanamine?
N-ethyl-N-(2-thiophen-2-ylethyl)cyclohexanamine has a molecular weight of 237.41 g/mol, XLogP of 3.95, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-thiophen-2-ylethyl)cyclohexanamine is sourced from PubChem (CID 150257047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).