1-[(thiolan-3-ylamino)methyl]cyclopentan-1-ol

C10H19NOS — CID 65105525

IUPAC1-[(thiolan-3-ylamino)methyl]cyclopentan-1-ol
SMILESOC1(CNC2CCSC2)CCCC1
InChIInChI=1S/C10H19NOS/c12-10(4-1-2-5-10)8-11-9-3-6-13-7-9/h9,11-12H,1-8H2
InChIKeyYYNXQFZEYYVGII-UHFFFAOYSA-N
MW201.33 g/mol
LogP1.39
Rot. Bonds3

About 1-[(thiolan-3-ylamino)methyl]cyclopentan-1-ol

1-[(thiolan-3-ylamino)methyl]cyclopentan-1-ol (PubChem CID 65105525) has the molecular formula C10H19NOS and a molecular weight of 201.33 g/mol. Its IUPAC name is 1-[(thiolan-3-ylamino)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[(thiolan-3-ylamino)methyl]cyclopentan-1-ol
PubChem CID65105525
Molecular FormulaC10H19NOS
Molecular Weight201.33 g/mol
Exact Mass201.12
IUPAC Name1-[(thiolan-3-ylamino)methyl]cyclopentan-1-ol
SMILESOC1(CNC2CCSC2)CCCC1
InChIInChI=1S/C10H19NOS/c12-10(4-1-2-5-10)8-11-9-3-6-13-7-9/h9,11-12H,1-8H2
InChIKeyYYNXQFZEYYVGII-UHFFFAOYSA-N
XLogP1.39
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.33
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(thiolan-3-ylamino)methyl]cyclopentan-1-ol?
The IUPAC name of 1-[(thiolan-3-ylamino)methyl]cyclopentan-1-ol (CID 65105525) is 1-[(thiolan-3-ylamino)methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[(thiolan-3-ylamino)methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[(thiolan-3-ylamino)methyl]cyclopentan-1-ol is OC1(CNC2CCSC2)CCCC1.
What is the InChIKey of 1-[(thiolan-3-ylamino)methyl]cyclopentan-1-ol?
The InChIKey is YYNXQFZEYYVGII-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NOS/c12-10(4-1-2-5-10)8-11-9-3-6-13-7-9/h9,11-12H,1-8H2.
What are the key properties of 1-[(thiolan-3-ylamino)methyl]cyclopentan-1-ol?
1-[(thiolan-3-ylamino)methyl]cyclopentan-1-ol has a molecular weight of 201.33 g/mol, XLogP of 1.39, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(thiolan-3-ylamino)methyl]cyclopentan-1-ol is sourced from PubChem (CID 65105525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).