2-piperidin-2-yl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine

C17H28N2S — CID 79553353

IUPAC2-piperidin-2-yl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine
SMILESCC(NC1CCCCC1C1CCCCN1)c1ccsc1
InChIInChI=1S/C17H28N2S/c1-13(14-9-11-20-12-14)19-17-8-3-2-6-15(17)16-7-4-5-10-18-16/h9,11-13,15-19H,2-8,10H2,1H3
InChIKeyIFSJAZCYQNHEIV-UHFFFAOYSA-N
MW292.49 g/mol
LogP4.10
Rot. Bonds4

About 2-piperidin-2-yl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine

2-piperidin-2-yl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine (PubChem CID 79553353) has the molecular formula C17H28N2S and a molecular weight of 292.49 g/mol. Its IUPAC name is 2-piperidin-2-yl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name2-piperidin-2-yl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine
PubChem CID79553353
Molecular FormulaC17H28N2S
Molecular Weight292.49 g/mol
Exact Mass292.20
IUPAC Name2-piperidin-2-yl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine
SMILESCC(NC1CCCCC1C1CCCCN1)c1ccsc1
InChIInChI=1S/C17H28N2S/c1-13(14-9-11-20-12-14)19-17-8-3-2-6-15(17)16-7-4-5-10-18-16/h9,11-13,15-19H,2-8,10H2,1H3
InChIKeyIFSJAZCYQNHEIV-UHFFFAOYSA-N
XLogP4.10
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.49
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-piperidin-2-yl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine?
The IUPAC name of 2-piperidin-2-yl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine (CID 79553353) is 2-piperidin-2-yl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine.
What is the SMILES notation for 2-piperidin-2-yl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine?
The canonical SMILES for 2-piperidin-2-yl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine is CC(NC1CCCCC1C1CCCCN1)c1ccsc1.
What is the InChIKey of 2-piperidin-2-yl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine?
The InChIKey is IFSJAZCYQNHEIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2S/c1-13(14-9-11-20-12-14)19-17-8-3-2-6-15(17)16-7-4-5-10-18-16/h9,11-13,15-19H,2-8,10H2,1H3.
What are the key properties of 2-piperidin-2-yl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine?
2-piperidin-2-yl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine has a molecular weight of 292.49 g/mol, XLogP of 4.10, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-2-yl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine is sourced from PubChem (CID 79553353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).