[1-(thiophen-2-ylmethylamino)cyclopentyl]methanol

C11H17NOS — CID 61054389

IUPAC[1-(thiophen-2-ylmethylamino)cyclopentyl]methanol
SMILESOCC1(NCc2cccs2)CCCC1
InChIInChI=1S/C11H17NOS/c13-9-11(5-1-2-6-11)12-8-10-4-3-7-14-10/h3-4,7,12-13H,1-2,5-6,8-9H2
InChIKeyTYICEJJTTLLKEE-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.14
Rot. Bonds4

About [1-(thiophen-2-ylmethylamino)cyclopentyl]methanol

[1-(thiophen-2-ylmethylamino)cyclopentyl]methanol (PubChem CID 61054389) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is [1-(thiophen-2-ylmethylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(thiophen-2-ylmethylamino)cyclopentyl]methanol
PubChem CID61054389
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC Name[1-(thiophen-2-ylmethylamino)cyclopentyl]methanol
SMILESOCC1(NCc2cccs2)CCCC1
InChIInChI=1S/C11H17NOS/c13-9-11(5-1-2-6-11)12-8-10-4-3-7-14-10/h3-4,7,12-13H,1-2,5-6,8-9H2
InChIKeyTYICEJJTTLLKEE-UHFFFAOYSA-N
XLogP2.14
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(thiophen-2-ylmethylamino)cyclopentyl]methanol?
The IUPAC name of [1-(thiophen-2-ylmethylamino)cyclopentyl]methanol (CID 61054389) is [1-(thiophen-2-ylmethylamino)cyclopentyl]methanol.
What is the SMILES notation for [1-(thiophen-2-ylmethylamino)cyclopentyl]methanol?
The canonical SMILES for [1-(thiophen-2-ylmethylamino)cyclopentyl]methanol is OCC1(NCc2cccs2)CCCC1.
What is the InChIKey of [1-(thiophen-2-ylmethylamino)cyclopentyl]methanol?
The InChIKey is TYICEJJTTLLKEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c13-9-11(5-1-2-6-11)12-8-10-4-3-7-14-10/h3-4,7,12-13H,1-2,5-6,8-9H2.
What are the key properties of [1-(thiophen-2-ylmethylamino)cyclopentyl]methanol?
[1-(thiophen-2-ylmethylamino)cyclopentyl]methanol has a molecular weight of 211.33 g/mol, XLogP of 2.14, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(thiophen-2-ylmethylamino)cyclopentyl]methanol is sourced from PubChem (CID 61054389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).