4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)oxane-4-carboxamide

C10H16N4O2S — CID 113335005

IUPAC4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)oxane-4-carboxamide
SMILESCCc1nnc(NC(=O)C2(N)CCOCC2)s1
InChIInChI=1S/C10H16N4O2S/c1-2-7-13-14-9(17-7)12-8(15)10(11)3-5-16-6-4-10/h2-6,11H2,1H3,(H,12,14,15)
InChIKeyNPKSOLNKQWCZOJ-UHFFFAOYSA-N
MW256.33 g/mol
LogP0.55
Rot. Bonds3

About 4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)oxane-4-carboxamide

4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)oxane-4-carboxamide (PubChem CID 113335005) has the molecular formula C10H16N4O2S and a molecular weight of 256.33 g/mol. Its IUPAC name is 4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)oxane-4-carboxamide.

Molecular Properties

Compound Name4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)oxane-4-carboxamide
PubChem CID113335005
Molecular FormulaC10H16N4O2S
Molecular Weight256.33 g/mol
Exact Mass256.10
IUPAC Name4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)oxane-4-carboxamide
SMILESCCc1nnc(NC(=O)C2(N)CCOCC2)s1
InChIInChI=1S/C10H16N4O2S/c1-2-7-13-14-9(17-7)12-8(15)10(11)3-5-16-6-4-10/h2-6,11H2,1H3,(H,12,14,15)
InChIKeyNPKSOLNKQWCZOJ-UHFFFAOYSA-N
XLogP0.55
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

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CID 119265205
1-amino-N-[5-[(4-methylphenyl)methyl]-1,3,4-thiadiazol-2-yl]cyclopropane-1-carboxamide;hydrochloride
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1-amino-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide
CID 119674558
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-morpholin-4-ylpropanamide
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5-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoyl]oxolane-2-carboxylic acid
CID 107641478
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120616725
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CID 119943678
4-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)oxane-4-carboxamide
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CID 129414179
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2,2-dimethylpropanamide
CID 692810
1-(benzenesulfonyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)cyclopentane-1-carboxamide
CID 16592029
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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)oxane-4-carboxamide?
The IUPAC name of 4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)oxane-4-carboxamide (CID 113335005) is 4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)oxane-4-carboxamide.
What is the SMILES notation for 4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)oxane-4-carboxamide?
The canonical SMILES for 4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)oxane-4-carboxamide is CCc1nnc(NC(=O)C2(N)CCOCC2)s1.
What is the InChIKey of 4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)oxane-4-carboxamide?
The InChIKey is NPKSOLNKQWCZOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2S/c1-2-7-13-14-9(17-7)12-8(15)10(11)3-5-16-6-4-10/h2-6,11H2,1H3,(H,12,14,15).
What are the key properties of 4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)oxane-4-carboxamide?
4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)oxane-4-carboxamide has a molecular weight of 256.33 g/mol, XLogP of 0.55, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)oxane-4-carboxamide is sourced from PubChem (CID 113335005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).