(2S)-3-methoxy-2-methyl-N-(thiadiazol-5-yl)propanamide

C7H11N3O2S — CID 99825110

IUPAC(2S)-3-methoxy-2-methyl-N-(thiadiazol-5-yl)propanamide
SMILESCOC[C@H](C)C(=O)Nc1cnns1
InChIInChI=1S/C7H11N3O2S/c1-5(4-12-2)7(11)9-6-3-8-10-13-6/h3,5H,4H2,1-2H3,(H,9,11)/t5-/m0/s1
InChIKeyRJINSAHAYUQLQT-YFKPBYRVSA-N
MW201.25 g/mol
LogP0.76
Rot. Bonds4

About (2S)-3-methoxy-2-methyl-N-(thiadiazol-5-yl)propanamide

(2S)-3-methoxy-2-methyl-N-(thiadiazol-5-yl)propanamide (PubChem CID 99825110) has the molecular formula C7H11N3O2S and a molecular weight of 201.25 g/mol. Its IUPAC name is (2S)-3-methoxy-2-methyl-N-(thiadiazol-5-yl)propanamide.

Molecular Properties

Compound Name(2S)-3-methoxy-2-methyl-N-(thiadiazol-5-yl)propanamide
PubChem CID99825110
Molecular FormulaC7H11N3O2S
Molecular Weight201.25 g/mol
Exact Mass201.06
IUPAC Name(2S)-3-methoxy-2-methyl-N-(thiadiazol-5-yl)propanamide
SMILESCOC[C@H](C)C(=O)Nc1cnns1
InChIInChI=1S/C7H11N3O2S/c1-5(4-12-2)7(11)9-6-3-8-10-13-6/h3,5H,4H2,1-2H3,(H,9,11)/t5-/m0/s1
InChIKeyRJINSAHAYUQLQT-YFKPBYRVSA-N
XLogP0.76
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.25
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-3,3,3-trifluoro-2-methyl-N-(thiadiazol-5-yl)propanamide
CID 124291931
(2S)-3,3,3-trifluoro-2-methyl-N-(thiadiazol-5-yl)propanamide
CID 124291932
3,3,3-trifluoro-2-methyl-N-(thiadiazol-5-yl)propanamide
CID 126795446
butyric acid-N-(1,2,3-thiadiazole-5-yl)-amide
CID 20432881
N-(thiadiazol-5-yl)propanamide
CID 103846147
3-methoxy-2-methyl-N-(thiadiazol-5-yl)propanamide
CID 91652293
4-methoxy-N-(thiadiazol-5-yl)butanamide
CID 99789680
(2R)-3-methoxy-2-methyl-N-(thiadiazol-5-yl)propanamide
CID 99825111
2-methoxy-N-(thiadiazol-5-yl)propanamide
CID 102707087
N-(thiadiazol-5-yl)cyclopropanecarboxamide
CID 102707088
2,2-dimethyl-N-(thiadiazol-5-yl)propanamide
CID 102979104
4-amino-3-methoxy-N-(thiadiazol-5-yl)butanamide
CID 103156849

Frequently Asked Questions

What is the IUPAC name of (2S)-3-methoxy-2-methyl-N-(thiadiazol-5-yl)propanamide?
The IUPAC name of (2S)-3-methoxy-2-methyl-N-(thiadiazol-5-yl)propanamide (CID 99825110) is (2S)-3-methoxy-2-methyl-N-(thiadiazol-5-yl)propanamide.
What is the SMILES notation for (2S)-3-methoxy-2-methyl-N-(thiadiazol-5-yl)propanamide?
The canonical SMILES for (2S)-3-methoxy-2-methyl-N-(thiadiazol-5-yl)propanamide is COC[C@H](C)C(=O)Nc1cnns1.
What is the InChIKey of (2S)-3-methoxy-2-methyl-N-(thiadiazol-5-yl)propanamide?
The InChIKey is RJINSAHAYUQLQT-YFKPBYRVSA-N. The full InChI is InChI=1S/C7H11N3O2S/c1-5(4-12-2)7(11)9-6-3-8-10-13-6/h3,5H,4H2,1-2H3,(H,9,11)/t5-/m0/s1.
What are the key properties of (2S)-3-methoxy-2-methyl-N-(thiadiazol-5-yl)propanamide?
(2S)-3-methoxy-2-methyl-N-(thiadiazol-5-yl)propanamide has a molecular weight of 201.25 g/mol, XLogP of 0.76, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-3-methoxy-2-methyl-N-(thiadiazol-5-yl)propanamide is sourced from PubChem (CID 99825110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).