N-(4-propylcyclohexyl)thiophen-3-amine

C13H21NS — CID 66350815

IUPACN-(4-propylcyclohexyl)thiophen-3-amine
SMILESCCCC1CCC(Nc2ccsc2)CC1
InChIInChI=1S/C13H21NS/c1-2-3-11-4-6-12(7-5-11)14-13-8-9-15-10-13/h8-12,14H,2-7H2,1H3
InChIKeyPBOKNIUTKOKNPP-UHFFFAOYSA-N
MW223.38 g/mol
LogP4.52
Rot. Bonds4

About N-(4-propylcyclohexyl)thiophen-3-amine

N-(4-propylcyclohexyl)thiophen-3-amine (PubChem CID 66350815) has the molecular formula C13H21NS and a molecular weight of 223.38 g/mol. Its IUPAC name is N-(4-propylcyclohexyl)thiophen-3-amine.

Molecular Properties

Compound NameN-(4-propylcyclohexyl)thiophen-3-amine
PubChem CID66350815
Molecular FormulaC13H21NS
Molecular Weight223.38 g/mol
Exact Mass223.14
IUPAC NameN-(4-propylcyclohexyl)thiophen-3-amine
SMILESCCCC1CCC(Nc2ccsc2)CC1
InChIInChI=1S/C13H21NS/c1-2-3-11-4-6-12(7-5-11)14-13-8-9-15-10-13/h8-12,14H,2-7H2,1H3
InChIKeyPBOKNIUTKOKNPP-UHFFFAOYSA-N
XLogP4.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.38
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-propylcyclohexyl)thiophen-3-amine?
The IUPAC name of N-(4-propylcyclohexyl)thiophen-3-amine (CID 66350815) is N-(4-propylcyclohexyl)thiophen-3-amine.
What is the SMILES notation for N-(4-propylcyclohexyl)thiophen-3-amine?
The canonical SMILES for N-(4-propylcyclohexyl)thiophen-3-amine is CCCC1CCC(Nc2ccsc2)CC1.
What is the InChIKey of N-(4-propylcyclohexyl)thiophen-3-amine?
The InChIKey is PBOKNIUTKOKNPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NS/c1-2-3-11-4-6-12(7-5-11)14-13-8-9-15-10-13/h8-12,14H,2-7H2,1H3.
What are the key properties of N-(4-propylcyclohexyl)thiophen-3-amine?
N-(4-propylcyclohexyl)thiophen-3-amine has a molecular weight of 223.38 g/mol, XLogP of 4.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-propylcyclohexyl)thiophen-3-amine is sourced from PubChem (CID 66350815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).