4-propyl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine

C15H25NS — CID 63454289

IUPAC4-propyl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine
SMILESCCCC1CCC(NC(C)c2ccsc2)CC1
InChIInChI=1S/C15H25NS/c1-3-4-13-5-7-15(8-6-13)16-12(2)14-9-10-17-11-14/h9-13,15-16H,3-8H2,1-2H3
InChIKeyUMETYPBYYRHERX-UHFFFAOYSA-N
MW251.44 g/mol
LogP4.76
Rot. Bonds5

About 4-propyl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine

4-propyl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine (PubChem CID 63454289) has the molecular formula C15H25NS and a molecular weight of 251.44 g/mol. Its IUPAC name is 4-propyl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-propyl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine
PubChem CID63454289
Molecular FormulaC15H25NS
Molecular Weight251.44 g/mol
Exact Mass251.17
IUPAC Name4-propyl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine
SMILESCCCC1CCC(NC(C)c2ccsc2)CC1
InChIInChI=1S/C15H25NS/c1-3-4-13-5-7-15(8-6-13)16-12(2)14-9-10-17-11-14/h9-13,15-16H,3-8H2,1-2H3
InChIKeyUMETYPBYYRHERX-UHFFFAOYSA-N
XLogP4.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.44
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-propyl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine?
The IUPAC name of 4-propyl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine (CID 63454289) is 4-propyl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine.
What is the SMILES notation for 4-propyl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine?
The canonical SMILES for 4-propyl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine is CCCC1CCC(NC(C)c2ccsc2)CC1.
What is the InChIKey of 4-propyl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine?
The InChIKey is UMETYPBYYRHERX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NS/c1-3-4-13-5-7-15(8-6-13)16-12(2)14-9-10-17-11-14/h9-13,15-16H,3-8H2,1-2H3.
What are the key properties of 4-propyl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine?
4-propyl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine has a molecular weight of 251.44 g/mol, XLogP of 4.76, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propyl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine is sourced from PubChem (CID 63454289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).