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

C8H8N4O2S — CID 79513071

IUPACN-(5-amino-1,3,4-thiadiazol-2-yl)-2-methylfuran-3-carboxamide
SMILESCc1occc1C(=O)Nc1nnc(N)s1
InChIInChI=1S/C8H8N4O2S/c1-4-5(2-3-14-4)6(13)10-8-12-11-7(9)15-8/h2-3H,1H3,(H2,9,11)(H,10,12,13)
InChIKeyXHBPDTQHQROXFT-UHFFFAOYSA-N
MW224.25 g/mol
LogP1.27
Rot. Bonds2

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

N-(5-amino-1,3,4-thiadiazol-2-yl)-2-methylfuran-3-carboxamide (PubChem CID 79513071) has the molecular formula C8H8N4O2S and a molecular weight of 224.25 g/mol. Its IUPAC name is N-(5-amino-1,3,4-thiadiazol-2-yl)-2-methylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(5-amino-1,3,4-thiadiazol-2-yl)-2-methylfuran-3-carboxamide
PubChem CID79513071
Molecular FormulaC8H8N4O2S
Molecular Weight224.25 g/mol
Exact Mass224.04
IUPAC NameN-(5-amino-1,3,4-thiadiazol-2-yl)-2-methylfuran-3-carboxamide
SMILESCc1occc1C(=O)Nc1nnc(N)s1
InChIInChI=1S/C8H8N4O2S/c1-4-5(2-3-14-4)6(13)10-8-12-11-7(9)15-8/h2-3H,1H3,(H2,9,11)(H,10,12,13)
InChIKeyXHBPDTQHQROXFT-UHFFFAOYSA-N
XLogP1.27
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.25
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(5-amino-1,3,4-thiadiazol-2-yl)-2-bromofuran-3-carboxamide
CID 106856525
N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-methylfuran-3-carboxamide
CID 31039084
N-(5-amino-1,3,4-thiadiazol-2-yl)-2-methylbenzamide
CID 79516914
2-methyl-N-(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)furan-3-carboxamide
CID 1224004
N-(5-amino-1,3,4-thiadiazol-2-yl)-2,3-dimethylbenzamide
CID 79513455
N-(5-amino-1,3,4-thiadiazol-2-yl)-2,5-dimethylbenzamide
CID 79513275
methyl 2-[(2-methylfuran-3-carbonyl)amino]-1,3-thiazole-5-carboxylate
CID 18103755
N-(5-amino-1,3,4-thiadiazol-2-yl)-2,5-difluorobenzamide
CID 79512495
N-(3-carbamoyl-5-propylthiophen-2-yl)-2-methylfuran-3-carboxamide
CID 1245035
N-(3-carbamoyl-5-methyl-4-phenylthiophen-2-yl)-2-methylfuran-3-carboxamide
CID 1245726
N-(5-amino-1,3,4-thiadiazol-2-yl)-5-chloro-2-methoxybenzamide
CID 79516243
N-(5-amino-1,3,4-thiadiazol-2-yl)-5-methyl-1-benzofuran-2-carboxamide
CID 79515377

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-1,3,4-thiadiazol-2-yl)-2-methylfuran-3-carboxamide?
The IUPAC name of N-(5-amino-1,3,4-thiadiazol-2-yl)-2-methylfuran-3-carboxamide (CID 79513071) is N-(5-amino-1,3,4-thiadiazol-2-yl)-2-methylfuran-3-carboxamide.
What is the SMILES notation for N-(5-amino-1,3,4-thiadiazol-2-yl)-2-methylfuran-3-carboxamide?
The canonical SMILES for N-(5-amino-1,3,4-thiadiazol-2-yl)-2-methylfuran-3-carboxamide is Cc1occc1C(=O)Nc1nnc(N)s1.
What is the InChIKey of N-(5-amino-1,3,4-thiadiazol-2-yl)-2-methylfuran-3-carboxamide?
The InChIKey is XHBPDTQHQROXFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O2S/c1-4-5(2-3-14-4)6(13)10-8-12-11-7(9)15-8/h2-3H,1H3,(H2,9,11)(H,10,12,13).
What are the key properties of N-(5-amino-1,3,4-thiadiazol-2-yl)-2-methylfuran-3-carboxamide?
N-(5-amino-1,3,4-thiadiazol-2-yl)-2-methylfuran-3-carboxamide has a molecular weight of 224.25 g/mol, XLogP of 1.27, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-1,3,4-thiadiazol-2-yl)-2-methylfuran-3-carboxamide is sourced from PubChem (CID 79513071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).