2-bromo-4-cyclohexylthiophen-3-amine

C10H14BrNS — CID 82380137

IUPAC2-bromo-4-cyclohexylthiophen-3-amine
SMILESNc1c(C2CCCCC2)csc1Br
InChIInChI=1S/C10H14BrNS/c11-10-9(12)8(6-13-10)7-4-2-1-3-5-7/h6-7H,1-5,12H2
InChIKeyWRUGSXOLYUFTGJ-UHFFFAOYSA-N
MW260.20 g/mol
LogP4.14
Rot. Bonds1

About 2-bromo-4-cyclohexylthiophen-3-amine

2-bromo-4-cyclohexylthiophen-3-amine (PubChem CID 82380137) has the molecular formula C10H14BrNS and a molecular weight of 260.20 g/mol. Its IUPAC name is 2-bromo-4-cyclohexylthiophen-3-amine.

Molecular Properties

Compound Name2-bromo-4-cyclohexylthiophen-3-amine
PubChem CID82380137
Molecular FormulaC10H14BrNS
Molecular Weight260.20 g/mol
Exact Mass259.00
IUPAC Name2-bromo-4-cyclohexylthiophen-3-amine
SMILESNc1c(C2CCCCC2)csc1Br
InChIInChI=1S/C10H14BrNS/c11-10-9(12)8(6-13-10)7-4-2-1-3-5-7/h6-7H,1-5,12H2
InChIKeyWRUGSXOLYUFTGJ-UHFFFAOYSA-N
XLogP4.14
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.20
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-4-cyclohexylthiophen-3-amine?
The IUPAC name of 2-bromo-4-cyclohexylthiophen-3-amine (CID 82380137) is 2-bromo-4-cyclohexylthiophen-3-amine.
What is the SMILES notation for 2-bromo-4-cyclohexylthiophen-3-amine?
The canonical SMILES for 2-bromo-4-cyclohexylthiophen-3-amine is Nc1c(C2CCCCC2)csc1Br.
What is the InChIKey of 2-bromo-4-cyclohexylthiophen-3-amine?
The InChIKey is WRUGSXOLYUFTGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrNS/c11-10-9(12)8(6-13-10)7-4-2-1-3-5-7/h6-7H,1-5,12H2.
What are the key properties of 2-bromo-4-cyclohexylthiophen-3-amine?
2-bromo-4-cyclohexylthiophen-3-amine has a molecular weight of 260.20 g/mol, XLogP of 4.14, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-4-cyclohexylthiophen-3-amine is sourced from PubChem (CID 82380137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).