cyclopentyl-(4-methoxythiophen-2-yl)methanamine

C11H17NOS — CID 115779094

IUPACcyclopentyl-(4-methoxythiophen-2-yl)methanamine
SMILESCOc1csc(C(N)C2CCCC2)c1
InChIInChI=1S/C11H17NOS/c1-13-9-6-10(14-7-9)11(12)8-4-2-3-5-8/h6-8,11H,2-5,12H2,1H3
InChIKeyRTERIVLRPXMKEB-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.95
Rot. Bonds3

About cyclopentyl-(4-methoxythiophen-2-yl)methanamine

cyclopentyl-(4-methoxythiophen-2-yl)methanamine (PubChem CID 115779094) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is cyclopentyl-(4-methoxythiophen-2-yl)methanamine.

Molecular Properties

Compound Namecyclopentyl-(4-methoxythiophen-2-yl)methanamine
PubChem CID115779094
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC Namecyclopentyl-(4-methoxythiophen-2-yl)methanamine
SMILESCOc1csc(C(N)C2CCCC2)c1
InChIInChI=1S/C11H17NOS/c1-13-9-6-10(14-7-9)11(12)8-4-2-3-5-8/h6-8,11H,2-5,12H2,1H3
InChIKeyRTERIVLRPXMKEB-UHFFFAOYSA-N
XLogP2.95
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of cyclopentyl-(4-methoxythiophen-2-yl)methanamine?
The IUPAC name of cyclopentyl-(4-methoxythiophen-2-yl)methanamine (CID 115779094) is cyclopentyl-(4-methoxythiophen-2-yl)methanamine.
What is the SMILES notation for cyclopentyl-(4-methoxythiophen-2-yl)methanamine?
The canonical SMILES for cyclopentyl-(4-methoxythiophen-2-yl)methanamine is COc1csc(C(N)C2CCCC2)c1.
What is the InChIKey of cyclopentyl-(4-methoxythiophen-2-yl)methanamine?
The InChIKey is RTERIVLRPXMKEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c1-13-9-6-10(14-7-9)11(12)8-4-2-3-5-8/h6-8,11H,2-5,12H2,1H3.
What are the key properties of cyclopentyl-(4-methoxythiophen-2-yl)methanamine?
cyclopentyl-(4-methoxythiophen-2-yl)methanamine has a molecular weight of 211.33 g/mol, XLogP of 2.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-(4-methoxythiophen-2-yl)methanamine is sourced from PubChem (CID 115779094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).