(3R)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]oxolane-3-carboxamide

C14H15N3O3S — CID 95313237

IUPAC(3R)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]oxolane-3-carboxamide
SMILESCOc1ccc(-c2nsc(NC(=O)[C@@H]3CCOC3)n2)cc1
InChIInChI=1S/C14H15N3O3S/c1-19-11-4-2-9(3-5-11)12-15-14(21-17-12)16-13(18)10-6-7-20-8-10/h2-5,10H,6-8H2,1H3,(H,15,16,17,18)/t10-/m1/s1
InChIKeyDGCXGYZJPBRGQT-SNVBAGLBSA-N
MW305.36 g/mol
LogP2.19
Rot. Bonds4

About (3R)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]oxolane-3-carboxamide

(3R)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]oxolane-3-carboxamide (PubChem CID 95313237) has the molecular formula C14H15N3O3S and a molecular weight of 305.36 g/mol. Its IUPAC name is (3R)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]oxolane-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]oxolane-3-carboxamide
PubChem CID95313237
Molecular FormulaC14H15N3O3S
Molecular Weight305.36 g/mol
Exact Mass305.08
IUPAC Name(3R)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]oxolane-3-carboxamide
SMILESCOc1ccc(-c2nsc(NC(=O)[C@@H]3CCOC3)n2)cc1
InChIInChI=1S/C14H15N3O3S/c1-19-11-4-2-9(3-5-11)12-15-14(21-17-12)16-13(18)10-6-7-20-8-10/h2-5,10H,6-8H2,1H3,(H,15,16,17,18)/t10-/m1/s1
InChIKeyDGCXGYZJPBRGQT-SNVBAGLBSA-N
XLogP2.19
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.36
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(3R)-N-[bis(4-methoxyphenyl)methyl]oxolane-3-carboxamide
CID 95275632
ethyl 5-(4-methoxyphenyl)-3-[[(3S)-oxolane-3-carbonyl]amino]thiophene-2-carboxylate
CID 97029225
(2S)-1-(4-chlorophenyl)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]-5-oxopyrrolidine-2-carboxamide
CID 67953374
1-(1,1-dioxo-1,4-thiazinane-4-carbonyl)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]piperidine-2-carboxamide
CID 76831460
(3S)-N-[[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methyl]oxolane-3-carboxamide
CID 95062342
N-[[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methyl]oxolane-3-carboxamide
CID 53049086
N-(3-phenyl-1,2,4-thiadiazol-5-yl)cyclohexanecarboxamide
CID 10637031
N-[3-(4-ethoxyphenyl)-1,2,4-thiadiazol-5-yl]-2-(4-methoxyphenoxy)acetamide
CID 35573064
N-(6-methoxypyridazin-3-yl)oxolane-3-carboxamide
CID 155503304
(2R)-2-(2-chlorophenoxy)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]propanamide
CID 42414828
N-(5-bromo-2-methoxyphenyl)oxolane-3-carboxamide
CID 47494478
(2S)-2-(2-methoxyphenoxy)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]propanamide
CID 42414813

Frequently Asked Questions

What is the IUPAC name of (3R)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]oxolane-3-carboxamide?
The IUPAC name of (3R)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]oxolane-3-carboxamide (CID 95313237) is (3R)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]oxolane-3-carboxamide.
What is the SMILES notation for (3R)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]oxolane-3-carboxamide?
The canonical SMILES for (3R)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]oxolane-3-carboxamide is COc1ccc(-c2nsc(NC(=O)[C@@H]3CCOC3)n2)cc1.
What is the InChIKey of (3R)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]oxolane-3-carboxamide?
The InChIKey is DGCXGYZJPBRGQT-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H15N3O3S/c1-19-11-4-2-9(3-5-11)12-15-14(21-17-12)16-13(18)10-6-7-20-8-10/h2-5,10H,6-8H2,1H3,(H,15,16,17,18)/t10-/m1/s1.
What are the key properties of (3R)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]oxolane-3-carboxamide?
(3R)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]oxolane-3-carboxamide has a molecular weight of 305.36 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]oxolane-3-carboxamide is sourced from PubChem (CID 95313237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).