[1-[(thiolan-3-ylmethylamino)methyl]cyclopropyl]methanol

C10H19NOS — CID 107132321

IUPAC[1-[(thiolan-3-ylmethylamino)methyl]cyclopropyl]methanol
SMILESOCC1(CNCC2CCSC2)CC1
InChIInChI=1S/C10H19NOS/c12-8-10(2-3-10)7-11-5-9-1-4-13-6-9/h9,11-12H,1-8H2
InChIKeyQMXGTSMHUJUVEG-UHFFFAOYSA-N
MW201.33 g/mol
LogP1.10
Rot. Bonds5

About [1-[(thiolan-3-ylmethylamino)methyl]cyclopropyl]methanol

[1-[(thiolan-3-ylmethylamino)methyl]cyclopropyl]methanol (PubChem CID 107132321) has the molecular formula C10H19NOS and a molecular weight of 201.33 g/mol. Its IUPAC name is [1-[(thiolan-3-ylmethylamino)methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[(thiolan-3-ylmethylamino)methyl]cyclopropyl]methanol
PubChem CID107132321
Molecular FormulaC10H19NOS
Molecular Weight201.33 g/mol
Exact Mass201.12
IUPAC Name[1-[(thiolan-3-ylmethylamino)methyl]cyclopropyl]methanol
SMILESOCC1(CNCC2CCSC2)CC1
InChIInChI=1S/C10H19NOS/c12-8-10(2-3-10)7-11-5-9-1-4-13-6-9/h9,11-12H,1-8H2
InChIKeyQMXGTSMHUJUVEG-UHFFFAOYSA-N
XLogP1.10
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.33
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-[(thiolan-3-ylmethylamino)methyl]cyclopropyl]methanol?
The IUPAC name of [1-[(thiolan-3-ylmethylamino)methyl]cyclopropyl]methanol (CID 107132321) is [1-[(thiolan-3-ylmethylamino)methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[(thiolan-3-ylmethylamino)methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[(thiolan-3-ylmethylamino)methyl]cyclopropyl]methanol is OCC1(CNCC2CCSC2)CC1.
What is the InChIKey of [1-[(thiolan-3-ylmethylamino)methyl]cyclopropyl]methanol?
The InChIKey is QMXGTSMHUJUVEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NOS/c12-8-10(2-3-10)7-11-5-9-1-4-13-6-9/h9,11-12H,1-8H2.
What are the key properties of [1-[(thiolan-3-ylmethylamino)methyl]cyclopropyl]methanol?
[1-[(thiolan-3-ylmethylamino)methyl]cyclopropyl]methanol has a molecular weight of 201.33 g/mol, XLogP of 1.10, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(thiolan-3-ylmethylamino)methyl]cyclopropyl]methanol is sourced from PubChem (CID 107132321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).