1-[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine

C6H7N5OS — CID 65215754

IUPAC1-[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine
SMILESCC(N)c1nnc(-c2csnn2)o1
InChIInChI=1S/C6H7N5OS/c1-3(7)5-9-10-6(12-5)4-2-13-11-8-4/h2-3H,7H2,1H3
InChIKeyIHNMINAYRGWBRX-UHFFFAOYSA-N
MW197.22 g/mol
LogP0.61
Rot. Bonds2

About 1-[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine

1-[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine (PubChem CID 65215754) has the molecular formula C6H7N5OS and a molecular weight of 197.22 g/mol. Its IUPAC name is 1-[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine.

Molecular Properties

Compound Name1-[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine
PubChem CID65215754
Molecular FormulaC6H7N5OS
Molecular Weight197.22 g/mol
Exact Mass197.04
IUPAC Name1-[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine
SMILESCC(N)c1nnc(-c2csnn2)o1
InChIInChI=1S/C6H7N5OS/c1-3(7)5-9-10-6(12-5)4-2-13-11-8-4/h2-3H,7H2,1H3
InChIKeyIHNMINAYRGWBRX-UHFFFAOYSA-N
XLogP0.61
TPSA90.72 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.22
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-(Thiadiazol-4-yl)-1,3,4-oxadiazole
CID 57471834
2-Ethyl-5-(thiadiazol-4-yl)-1,3,4-oxadiazole
CID 130634291
2-(Chloromethyl)-5-(thiadiazol-4-yl)-1,3,4-oxadiazole
CID 65214087
2-(1-Chloroethyl)-5-(thiadiazol-4-yl)-1,3,4-oxadiazole
CID 65214089
2-(2-Chloroethyl)-5-(thiadiazol-4-yl)-1,3,4-oxadiazole
CID 65214140
5-(Thiadiazol-4-yl)-1,3,4-oxadiazol-2-amine
CID 65214775
N-methyl-1-[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]methanamine
CID 65215755
N-[[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]ethanamine
CID 65215756
N-[[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]propan-1-amine
CID 65215757
N-[[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine
CID 65215812
N-[[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]cyclopropanamine
CID 65215813
2-methyl-N-[[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine
CID 65215814

Frequently Asked Questions

What is the IUPAC name of 1-[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine?
The IUPAC name of 1-[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine (CID 65215754) is 1-[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine.
What is the SMILES notation for 1-[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine?
The canonical SMILES for 1-[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine is CC(N)c1nnc(-c2csnn2)o1.
What is the InChIKey of 1-[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine?
The InChIKey is IHNMINAYRGWBRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N5OS/c1-3(7)5-9-10-6(12-5)4-2-13-11-8-4/h2-3H,7H2,1H3.
What are the key properties of 1-[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine?
1-[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine has a molecular weight of 197.22 g/mol, XLogP of 0.61, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(thiadiazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine is sourced from PubChem (CID 65215754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).