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

C7H11N3O2S — CID 99791065

IUPAC(2R)-2-ethoxy-N-(thiadiazol-5-yl)propanamide
SMILESCCO[C@H](C)C(=O)Nc1cnns1
InChIInChI=1S/C7H11N3O2S/c1-3-12-5(2)7(11)9-6-4-8-10-13-6/h4-5H,3H2,1-2H3,(H,9,11)/t5-/m1/s1
InChIKeyDNPLSEVDMTZQEW-RXMQYKEDSA-N
MW201.25 g/mol
LogP0.90
Rot. Bonds4

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

(2R)-2-ethoxy-N-(thiadiazol-5-yl)propanamide (PubChem CID 99791065) has the molecular formula C7H11N3O2S and a molecular weight of 201.25 g/mol. Its IUPAC name is (2R)-2-ethoxy-N-(thiadiazol-5-yl)propanamide.

Molecular Properties

Compound Name(2R)-2-ethoxy-N-(thiadiazol-5-yl)propanamide
PubChem CID99791065
Molecular FormulaC7H11N3O2S
Molecular Weight201.25 g/mol
Exact Mass201.06
IUPAC Name(2R)-2-ethoxy-N-(thiadiazol-5-yl)propanamide
SMILESCCO[C@H](C)C(=O)Nc1cnns1
InChIInChI=1S/C7H11N3O2S/c1-3-12-5(2)7(11)9-6-4-8-10-13-6/h4-5H,3H2,1-2H3,(H,9,11)/t5-/m1/s1
InChIKeyDNPLSEVDMTZQEW-RXMQYKEDSA-N
XLogP0.90
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 ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-ethoxy-N-(thiadiazol-5-yl)propanamide?
The IUPAC name of (2R)-2-ethoxy-N-(thiadiazol-5-yl)propanamide (CID 99791065) is (2R)-2-ethoxy-N-(thiadiazol-5-yl)propanamide.
What is the SMILES notation for (2R)-2-ethoxy-N-(thiadiazol-5-yl)propanamide?
The canonical SMILES for (2R)-2-ethoxy-N-(thiadiazol-5-yl)propanamide is CCO[C@H](C)C(=O)Nc1cnns1.
What is the InChIKey of (2R)-2-ethoxy-N-(thiadiazol-5-yl)propanamide?
The InChIKey is DNPLSEVDMTZQEW-RXMQYKEDSA-N. The full InChI is InChI=1S/C7H11N3O2S/c1-3-12-5(2)7(11)9-6-4-8-10-13-6/h4-5H,3H2,1-2H3,(H,9,11)/t5-/m1/s1.
What are the key properties of (2R)-2-ethoxy-N-(thiadiazol-5-yl)propanamide?
(2R)-2-ethoxy-N-(thiadiazol-5-yl)propanamide has a molecular weight of 201.25 g/mol, XLogP of 0.90, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-ethoxy-N-(thiadiazol-5-yl)propanamide is sourced from PubChem (CID 99791065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).