(2R)-N-(2-chlorothiophen-3-yl)-2-hydroxypropanamide

C7H8ClNO2S — CID 131154583

IUPAC(2R)-N-(2-chlorothiophen-3-yl)-2-hydroxypropanamide
SMILESC[C@@H](O)C(=O)Nc1ccsc1Cl
InChIInChI=1S/C7H8ClNO2S/c1-4(10)7(11)9-5-2-3-12-6(5)8/h2-4,10H,1H3,(H,9,11)/t4-/m1/s1
InChIKeyDTUFQRLSYIEYAT-SCSAIBSYSA-N
MW205.67 g/mol
LogP1.72
Rot. Bonds2

About (2R)-N-(2-chlorothiophen-3-yl)-2-hydroxypropanamide

(2R)-N-(2-chlorothiophen-3-yl)-2-hydroxypropanamide (PubChem CID 131154583) has the molecular formula C7H8ClNO2S and a molecular weight of 205.67 g/mol. Its IUPAC name is (2R)-N-(2-chlorothiophen-3-yl)-2-hydroxypropanamide.

Molecular Properties

Compound Name(2R)-N-(2-chlorothiophen-3-yl)-2-hydroxypropanamide
PubChem CID131154583
Molecular FormulaC7H8ClNO2S
Molecular Weight205.67 g/mol
Exact Mass205.00
IUPAC Name(2R)-N-(2-chlorothiophen-3-yl)-2-hydroxypropanamide
SMILESC[C@@H](O)C(=O)Nc1ccsc1Cl
InChIInChI=1S/C7H8ClNO2S/c1-4(10)7(11)9-5-2-3-12-6(5)8/h2-4,10H,1H3,(H,9,11)/t4-/m1/s1
InChIKeyDTUFQRLSYIEYAT-SCSAIBSYSA-N
XLogP1.72
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.67
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2-chlorothiophen-3-yl)-2-hydroxypropanamide?
The IUPAC name of (2R)-N-(2-chlorothiophen-3-yl)-2-hydroxypropanamide (CID 131154583) is (2R)-N-(2-chlorothiophen-3-yl)-2-hydroxypropanamide.
What is the SMILES notation for (2R)-N-(2-chlorothiophen-3-yl)-2-hydroxypropanamide?
The canonical SMILES for (2R)-N-(2-chlorothiophen-3-yl)-2-hydroxypropanamide is C[C@@H](O)C(=O)Nc1ccsc1Cl.
What is the InChIKey of (2R)-N-(2-chlorothiophen-3-yl)-2-hydroxypropanamide?
The InChIKey is DTUFQRLSYIEYAT-SCSAIBSYSA-N. The full InChI is InChI=1S/C7H8ClNO2S/c1-4(10)7(11)9-5-2-3-12-6(5)8/h2-4,10H,1H3,(H,9,11)/t4-/m1/s1.
What are the key properties of (2R)-N-(2-chlorothiophen-3-yl)-2-hydroxypropanamide?
(2R)-N-(2-chlorothiophen-3-yl)-2-hydroxypropanamide has a molecular weight of 205.67 g/mol, XLogP of 1.72, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2-chlorothiophen-3-yl)-2-hydroxypropanamide is sourced from PubChem (CID 131154583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).