(2R)-2-phenyl-N-(thiadiazol-5-yl)propanamide

C11H11N3OS — CID 99825167

IUPAC(2R)-2-phenyl-N-(thiadiazol-5-yl)propanamide
SMILESC[C@@H](C(=O)Nc1cnns1)c1ccccc1
InChIInChI=1S/C11H11N3OS/c1-8(9-5-3-2-4-6-9)11(15)13-10-7-12-14-16-10/h2-8H,1H3,(H,13,15)/t8-/m1/s1
InChIKeyFRKLKVCXYQEUNO-MRVPVSSYSA-N
MW233.30 g/mol
LogP2.28
Rot. Bonds3

About (2R)-2-phenyl-N-(thiadiazol-5-yl)propanamide

(2R)-2-phenyl-N-(thiadiazol-5-yl)propanamide (PubChem CID 99825167) has the molecular formula C11H11N3OS and a molecular weight of 233.30 g/mol. Its IUPAC name is (2R)-2-phenyl-N-(thiadiazol-5-yl)propanamide.

Molecular Properties

Compound Name(2R)-2-phenyl-N-(thiadiazol-5-yl)propanamide
PubChem CID99825167
Molecular FormulaC11H11N3OS
Molecular Weight233.30 g/mol
Exact Mass233.06
IUPAC Name(2R)-2-phenyl-N-(thiadiazol-5-yl)propanamide
SMILESC[C@@H](C(=O)Nc1cnns1)c1ccccc1
InChIInChI=1S/C11H11N3OS/c1-8(9-5-3-2-4-6-9)11(15)13-10-7-12-14-16-10/h2-8H,1H3,(H,13,15)/t8-/m1/s1
InChIKeyFRKLKVCXYQEUNO-MRVPVSSYSA-N
XLogP2.28
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.30
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-phenyl-N-(thiadiazol-5-yl)propanamide?
The IUPAC name of (2R)-2-phenyl-N-(thiadiazol-5-yl)propanamide (CID 99825167) is (2R)-2-phenyl-N-(thiadiazol-5-yl)propanamide.
What is the SMILES notation for (2R)-2-phenyl-N-(thiadiazol-5-yl)propanamide?
The canonical SMILES for (2R)-2-phenyl-N-(thiadiazol-5-yl)propanamide is C[C@@H](C(=O)Nc1cnns1)c1ccccc1.
What is the InChIKey of (2R)-2-phenyl-N-(thiadiazol-5-yl)propanamide?
The InChIKey is FRKLKVCXYQEUNO-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H11N3OS/c1-8(9-5-3-2-4-6-9)11(15)13-10-7-12-14-16-10/h2-8H,1H3,(H,13,15)/t8-/m1/s1.
What are the key properties of (2R)-2-phenyl-N-(thiadiazol-5-yl)propanamide?
(2R)-2-phenyl-N-(thiadiazol-5-yl)propanamide has a molecular weight of 233.30 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-phenyl-N-(thiadiazol-5-yl)propanamide is sourced from PubChem (CID 99825167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).