2-cyclohexyl-1-(5-ethylthiophen-2-yl)ethanamine

C14H23NS — CID 43103045

IUPAC2-cyclohexyl-1-(5-ethylthiophen-2-yl)ethanamine
SMILESCCc1ccc(C(N)CC2CCCCC2)s1
InChIInChI=1S/C14H23NS/c1-2-12-8-9-14(16-12)13(15)10-11-6-4-3-5-7-11/h8-9,11,13H,2-7,10,15H2,1H3
InChIKeyYTCNGCUOUOQFSO-UHFFFAOYSA-N
MW237.41 g/mol
LogP4.28
Rot. Bonds4

About 2-cyclohexyl-1-(5-ethylthiophen-2-yl)ethanamine

2-cyclohexyl-1-(5-ethylthiophen-2-yl)ethanamine (PubChem CID 43103045) has the molecular formula C14H23NS and a molecular weight of 237.41 g/mol. Its IUPAC name is 2-cyclohexyl-1-(5-ethylthiophen-2-yl)ethanamine.

Molecular Properties

Compound Name2-cyclohexyl-1-(5-ethylthiophen-2-yl)ethanamine
PubChem CID43103045
Molecular FormulaC14H23NS
Molecular Weight237.41 g/mol
Exact Mass237.16
IUPAC Name2-cyclohexyl-1-(5-ethylthiophen-2-yl)ethanamine
SMILESCCc1ccc(C(N)CC2CCCCC2)s1
InChIInChI=1S/C14H23NS/c1-2-12-8-9-14(16-12)13(15)10-11-6-4-3-5-7-11/h8-9,11,13H,2-7,10,15H2,1H3
InChIKeyYTCNGCUOUOQFSO-UHFFFAOYSA-N
XLogP4.28
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 ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-(5-ethylthiophen-2-yl)ethanamine?
The IUPAC name of 2-cyclohexyl-1-(5-ethylthiophen-2-yl)ethanamine (CID 43103045) is 2-cyclohexyl-1-(5-ethylthiophen-2-yl)ethanamine.
What is the SMILES notation for 2-cyclohexyl-1-(5-ethylthiophen-2-yl)ethanamine?
The canonical SMILES for 2-cyclohexyl-1-(5-ethylthiophen-2-yl)ethanamine is CCc1ccc(C(N)CC2CCCCC2)s1.
What is the InChIKey of 2-cyclohexyl-1-(5-ethylthiophen-2-yl)ethanamine?
The InChIKey is YTCNGCUOUOQFSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NS/c1-2-12-8-9-14(16-12)13(15)10-11-6-4-3-5-7-11/h8-9,11,13H,2-7,10,15H2,1H3.
What are the key properties of 2-cyclohexyl-1-(5-ethylthiophen-2-yl)ethanamine?
2-cyclohexyl-1-(5-ethylthiophen-2-yl)ethanamine has a molecular weight of 237.41 g/mol, XLogP of 4.28, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-(5-ethylthiophen-2-yl)ethanamine is sourced from PubChem (CID 43103045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).