1-(4-ethylthiadiazol-5-yl)-2-(2-methyltetrazol-5-yl)ethanamine

C8H13N7S — CID 107064868

IUPAC1-(4-ethylthiadiazol-5-yl)-2-(2-methyltetrazol-5-yl)ethanamine
SMILESCCc1nnsc1C(N)Cc1nnn(C)n1
InChIInChI=1S/C8H13N7S/c1-3-6-8(16-14-10-6)5(9)4-7-11-13-15(2)12-7/h5H,3-4,9H2,1-2H3
InChIKeyOVKVFBXCKNBLTF-UHFFFAOYSA-N
MW239.31 g/mol
LogP-0.13
Rot. Bonds4

About 1-(4-ethylthiadiazol-5-yl)-2-(2-methyltetrazol-5-yl)ethanamine

1-(4-ethylthiadiazol-5-yl)-2-(2-methyltetrazol-5-yl)ethanamine (PubChem CID 107064868) has the molecular formula C8H13N7S and a molecular weight of 239.31 g/mol. Its IUPAC name is 1-(4-ethylthiadiazol-5-yl)-2-(2-methyltetrazol-5-yl)ethanamine.

Molecular Properties

Compound Name1-(4-ethylthiadiazol-5-yl)-2-(2-methyltetrazol-5-yl)ethanamine
PubChem CID107064868
Molecular FormulaC8H13N7S
Molecular Weight239.31 g/mol
Exact Mass239.10
IUPAC Name1-(4-ethylthiadiazol-5-yl)-2-(2-methyltetrazol-5-yl)ethanamine
SMILESCCc1nnsc1C(N)Cc1nnn(C)n1
InChIInChI=1S/C8H13N7S/c1-3-6-8(16-14-10-6)5(9)4-7-11-13-15(2)12-7/h5H,3-4,9H2,1-2H3
InChIKeyOVKVFBXCKNBLTF-UHFFFAOYSA-N
XLogP-0.13
TPSA95.40 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.31
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

1-(3-ethyl-1-methylpyrazol-4-yl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107064883
1-(4-ethylthiadiazol-5-yl)-2-(1-methylimidazol-2-yl)ethanamine
CID 105167023
1-(4-ethylthiadiazol-5-yl)-2-phenylethanamine
CID 105084360
1-(4-ethylthiadiazol-5-yl)-2-thiophen-3-ylethanamine
CID 105137431
1,1-diethoxy-3-(2-methyltetrazol-5-yl)propan-2-amine
CID 107050132
2-cyclopropyl-1-(4-ethylthiadiazol-5-yl)ethanamine
CID 105152733
2-(2-bromophenyl)-1-(4-ethylthiadiazol-5-yl)ethanamine
CID 105087328
1-(4-chlorophenyl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107048349
1-(2,5-dibromothiophen-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107969527
1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107065432
2-(2-methyltetrazol-5-yl)-1-(3,4,5-trifluorophenyl)ethanamine
CID 107048810
1-(5-bromofuran-2-yl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107064809

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylthiadiazol-5-yl)-2-(2-methyltetrazol-5-yl)ethanamine?
The IUPAC name of 1-(4-ethylthiadiazol-5-yl)-2-(2-methyltetrazol-5-yl)ethanamine (CID 107064868) is 1-(4-ethylthiadiazol-5-yl)-2-(2-methyltetrazol-5-yl)ethanamine.
What is the SMILES notation for 1-(4-ethylthiadiazol-5-yl)-2-(2-methyltetrazol-5-yl)ethanamine?
The canonical SMILES for 1-(4-ethylthiadiazol-5-yl)-2-(2-methyltetrazol-5-yl)ethanamine is CCc1nnsc1C(N)Cc1nnn(C)n1.
What is the InChIKey of 1-(4-ethylthiadiazol-5-yl)-2-(2-methyltetrazol-5-yl)ethanamine?
The InChIKey is OVKVFBXCKNBLTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N7S/c1-3-6-8(16-14-10-6)5(9)4-7-11-13-15(2)12-7/h5H,3-4,9H2,1-2H3.
What are the key properties of 1-(4-ethylthiadiazol-5-yl)-2-(2-methyltetrazol-5-yl)ethanamine?
1-(4-ethylthiadiazol-5-yl)-2-(2-methyltetrazol-5-yl)ethanamine has a molecular weight of 239.31 g/mol, XLogP of -0.13, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylthiadiazol-5-yl)-2-(2-methyltetrazol-5-yl)ethanamine is sourced from PubChem (CID 107064868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).