[(2R)-morpholin-2-yl]methanethiol

C5H11NOS — CID 147254265

IUPAC[(2R)-morpholin-2-yl]methanethiol
SMILESSC[C@H]1CNCCO1
InChIInChI=1S/C5H11NOS/c8-4-5-3-6-1-2-7-5/h5-6,8H,1-4H2/t5-/m1/s1
InChIKeyCNGZTXTYUFPYRC-RXMQYKEDSA-N
MW133.22 g/mol
LogP-0.10
Rot. Bonds1

About [(2R)-morpholin-2-yl]methanethiol

[(2R)-morpholin-2-yl]methanethiol (PubChem CID 147254265) has the molecular formula C5H11NOS and a molecular weight of 133.22 g/mol. Its IUPAC name is [(2R)-morpholin-2-yl]methanethiol.

Molecular Properties

Compound Name[(2R)-morpholin-2-yl]methanethiol
PubChem CID147254265
Molecular FormulaC5H11NOS
Molecular Weight133.22 g/mol
Exact Mass133.06
IUPAC Name[(2R)-morpholin-2-yl]methanethiol
SMILESSC[C@H]1CNCCO1
InChIInChI=1S/C5H11NOS/c8-4-5-3-6-1-2-7-5/h5-6,8H,1-4H2/t5-/m1/s1
InChIKeyCNGZTXTYUFPYRC-RXMQYKEDSA-N
XLogP-0.10
TPSA21.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.22
LogP ≤ 5-0.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

((2S)-morpholin-2-yl)methanethiol hydrochloride
CID 165943618
[(2R)-morpholin-2-yl]methanethiol hydrochloride
CID 165946155
(Thio)morpholine
CID 20573956
Ethanethiol;morpholine
CID 18958641
2-Ethylmorpholine-2-thiol
CID 20568449
Morpholine-2-carbodithioic acid
CID 21114968
Morpholine-2-carbothioamide
CID 21455892
1-Morpholin-2-ylethanethione
CID 21691015
Morpholine-3-thiol
CID 21882649
1-(Morpholin-2-yl)ethane-1-thiol
CID 22035336
2-Morpholin-4-ium-4-ylethanethiol
CID 40511653
2-Morpholin-3-ylethanethiol
CID 57310825

Frequently Asked Questions

What is the IUPAC name of [(2R)-morpholin-2-yl]methanethiol?
The IUPAC name of [(2R)-morpholin-2-yl]methanethiol (CID 147254265) is [(2R)-morpholin-2-yl]methanethiol.
What is the SMILES notation for [(2R)-morpholin-2-yl]methanethiol?
The canonical SMILES for [(2R)-morpholin-2-yl]methanethiol is SC[C@H]1CNCCO1.
What is the InChIKey of [(2R)-morpholin-2-yl]methanethiol?
The InChIKey is CNGZTXTYUFPYRC-RXMQYKEDSA-N. The full InChI is InChI=1S/C5H11NOS/c8-4-5-3-6-1-2-7-5/h5-6,8H,1-4H2/t5-/m1/s1.
What are the key properties of [(2R)-morpholin-2-yl]methanethiol?
[(2R)-morpholin-2-yl]methanethiol has a molecular weight of 133.22 g/mol, XLogP of -0.10, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-morpholin-2-yl]methanethiol is sourced from PubChem (CID 147254265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).