(R)-2-methyl-N-[(1R)-1-thiophen-3-ylethyl]propane-2-sulfinamide

C10H17NOS2 — CID 162412188

IUPAC(R)-2-methyl-N-[(1R)-1-thiophen-3-ylethyl]propane-2-sulfinamide
SMILESC[C@@H](N[S@](=O)C(C)(C)C)c1ccsc1
InChIInChI=1S/C10H17NOS2/c1-8(9-5-6-13-7-9)11-14(12)10(2,3)4/h5-8,11H,1-4H3/t8-,14-/m1/s1
InChIKeyQFBVZNCQRNLJLS-XLKFXECMSA-N
MW231.39 g/mol
LogP2.86
Rot. Bonds3

About (R)-2-methyl-N-[(1R)-1-thiophen-3-ylethyl]propane-2-sulfinamide

(R)-2-methyl-N-[(1R)-1-thiophen-3-ylethyl]propane-2-sulfinamide (PubChem CID 162412188) has the molecular formula C10H17NOS2 and a molecular weight of 231.39 g/mol. Its IUPAC name is (R)-2-methyl-N-[(1R)-1-thiophen-3-ylethyl]propane-2-sulfinamide.

Molecular Properties

Compound Name(R)-2-methyl-N-[(1R)-1-thiophen-3-ylethyl]propane-2-sulfinamide
PubChem CID162412188
Molecular FormulaC10H17NOS2
Molecular Weight231.39 g/mol
Exact Mass231.08
IUPAC Name(R)-2-methyl-N-[(1R)-1-thiophen-3-ylethyl]propane-2-sulfinamide
SMILESC[C@@H](N[S@](=O)C(C)(C)C)c1ccsc1
InChIInChI=1S/C10H17NOS2/c1-8(9-5-6-13-7-9)11-14(12)10(2,3)4/h5-8,11H,1-4H3/t8-,14-/m1/s1
InChIKeyQFBVZNCQRNLJLS-XLKFXECMSA-N
XLogP2.86
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.39
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (R)-2-methyl-N-[(1R)-1-thiophen-3-ylethyl]propane-2-sulfinamide?
The IUPAC name of (R)-2-methyl-N-[(1R)-1-thiophen-3-ylethyl]propane-2-sulfinamide (CID 162412188) is (R)-2-methyl-N-[(1R)-1-thiophen-3-ylethyl]propane-2-sulfinamide.
What is the SMILES notation for (R)-2-methyl-N-[(1R)-1-thiophen-3-ylethyl]propane-2-sulfinamide?
The canonical SMILES for (R)-2-methyl-N-[(1R)-1-thiophen-3-ylethyl]propane-2-sulfinamide is C[C@@H](N[S@](=O)C(C)(C)C)c1ccsc1.
What is the InChIKey of (R)-2-methyl-N-[(1R)-1-thiophen-3-ylethyl]propane-2-sulfinamide?
The InChIKey is QFBVZNCQRNLJLS-XLKFXECMSA-N. The full InChI is InChI=1S/C10H17NOS2/c1-8(9-5-6-13-7-9)11-14(12)10(2,3)4/h5-8,11H,1-4H3/t8-,14-/m1/s1.
What are the key properties of (R)-2-methyl-N-[(1R)-1-thiophen-3-ylethyl]propane-2-sulfinamide?
(R)-2-methyl-N-[(1R)-1-thiophen-3-ylethyl]propane-2-sulfinamide has a molecular weight of 231.39 g/mol, XLogP of 2.86, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-2-methyl-N-[(1R)-1-thiophen-3-ylethyl]propane-2-sulfinamide is sourced from PubChem (CID 162412188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).