[3-(cyclopropylamino)thiolan-3-yl]methanol

C8H15NOS — CID 61055402

IUPAC[3-(cyclopropylamino)thiolan-3-yl]methanol
SMILESOCC1(NC2CC2)CCSC1
InChIInChI=1S/C8H15NOS/c10-5-8(3-4-11-6-8)9-7-1-2-7/h7,9-10H,1-6H2
InChIKeyKAMDHFKFTYJUSH-UHFFFAOYSA-N
MW173.28 g/mol
LogP0.61
Rot. Bonds3

About [3-(cyclopropylamino)thiolan-3-yl]methanol

[3-(cyclopropylamino)thiolan-3-yl]methanol (PubChem CID 61055402) has the molecular formula C8H15NOS and a molecular weight of 173.28 g/mol. Its IUPAC name is [3-(cyclopropylamino)thiolan-3-yl]methanol.

Molecular Properties

Compound Name[3-(cyclopropylamino)thiolan-3-yl]methanol
PubChem CID61055402
Molecular FormulaC8H15NOS
Molecular Weight173.28 g/mol
Exact Mass173.09
IUPAC Name[3-(cyclopropylamino)thiolan-3-yl]methanol
SMILESOCC1(NC2CC2)CCSC1
InChIInChI=1S/C8H15NOS/c10-5-8(3-4-11-6-8)9-7-1-2-7/h7,9-10H,1-6H2
InChIKeyKAMDHFKFTYJUSH-UHFFFAOYSA-N
XLogP0.61
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.28
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [3-(cyclopropylamino)thiolan-3-yl]methanol?
The IUPAC name of [3-(cyclopropylamino)thiolan-3-yl]methanol (CID 61055402) is [3-(cyclopropylamino)thiolan-3-yl]methanol.
What is the SMILES notation for [3-(cyclopropylamino)thiolan-3-yl]methanol?
The canonical SMILES for [3-(cyclopropylamino)thiolan-3-yl]methanol is OCC1(NC2CC2)CCSC1.
What is the InChIKey of [3-(cyclopropylamino)thiolan-3-yl]methanol?
The InChIKey is KAMDHFKFTYJUSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NOS/c10-5-8(3-4-11-6-8)9-7-1-2-7/h7,9-10H,1-6H2.
What are the key properties of [3-(cyclopropylamino)thiolan-3-yl]methanol?
[3-(cyclopropylamino)thiolan-3-yl]methanol has a molecular weight of 173.28 g/mol, XLogP of 0.61, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(cyclopropylamino)thiolan-3-yl]methanol is sourced from PubChem (CID 61055402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).