5-(1-fluoro-2-methylpropan-2-yl)-1,3,4-thiadiazol-2-amine

C6H10FN3S — CID 71407066

IUPAC5-(1-fluoro-2-methylpropan-2-yl)-1,3,4-thiadiazol-2-amine
SMILESCC(C)(CF)c1nnc(N)s1
InChIInChI=1S/C6H10FN3S/c1-6(2,3-7)4-9-10-5(8)11-4/h3H2,1-2H3,(H2,8,10)
InChIKeyWUGDQWAFIOTXTP-UHFFFAOYSA-N
MW175.23 g/mol
LogP1.37
Rot. Bonds2

About 5-(1-fluoro-2-methylpropan-2-yl)-1,3,4-thiadiazol-2-amine

5-(1-fluoro-2-methylpropan-2-yl)-1,3,4-thiadiazol-2-amine (PubChem CID 71407066) has the molecular formula C6H10FN3S and a molecular weight of 175.23 g/mol. Its IUPAC name is 5-(1-fluoro-2-methylpropan-2-yl)-1,3,4-thiadiazol-2-amine.

Molecular Properties

Compound Name5-(1-fluoro-2-methylpropan-2-yl)-1,3,4-thiadiazol-2-amine
PubChem CID71407066
Molecular FormulaC6H10FN3S
Molecular Weight175.23 g/mol
Exact Mass175.06
IUPAC Name5-(1-fluoro-2-methylpropan-2-yl)-1,3,4-thiadiazol-2-amine
SMILESCC(C)(CF)c1nnc(N)s1
InChIInChI=1S/C6H10FN3S/c1-6(2,3-7)4-9-10-5(8)11-4/h3H2,1-2H3,(H2,8,10)
InChIKeyWUGDQWAFIOTXTP-UHFFFAOYSA-N
XLogP1.37
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-Amino-5-ethyl-1,3,4-thiadiazole
CID 26444
Buthidazolamine
CID 170170
5-Propyl-1,3,4-thiadiazol-2-amine
CID 575394
5-Isopropyl-1,3,4-thiadiazol-2-amine
CID 147151
5-(2-Methylpropyl)-1,3,4-thiadiazol-2-amine
CID 234308
5-sec-Butyl-[1,3,4]thiadiazol-2-ylamine
CID 3455942
1,3,4-Thiadiazole, 2-amino-5-ethyl-, hydrochloride
CID 11971454
5-(2,2,2-Trifluoroethyl)-1,3,4-thiadiazol-2-amine
CID 43649092
5-(2,2-Dimethylpropyl)-1,3,4-thiadiazol-2-amine
CID 4692541
5-(1,1-Dimethylpropyl)-1,3,4-thiadiazol-2-amine
CID 795351
5-(1-(Trifluoromethyl)cyclopropyl)-1,3,4-thiadiazol-2-amine
CID 67544203
5-(1,1-Difluoroethyl)-1,3,4-thiadiazol-2-amine
CID 89873206

Frequently Asked Questions

What is the IUPAC name of 5-(1-fluoro-2-methylpropan-2-yl)-1,3,4-thiadiazol-2-amine?
The IUPAC name of 5-(1-fluoro-2-methylpropan-2-yl)-1,3,4-thiadiazol-2-amine (CID 71407066) is 5-(1-fluoro-2-methylpropan-2-yl)-1,3,4-thiadiazol-2-amine.
What is the SMILES notation for 5-(1-fluoro-2-methylpropan-2-yl)-1,3,4-thiadiazol-2-amine?
The canonical SMILES for 5-(1-fluoro-2-methylpropan-2-yl)-1,3,4-thiadiazol-2-amine is CC(C)(CF)c1nnc(N)s1.
What is the InChIKey of 5-(1-fluoro-2-methylpropan-2-yl)-1,3,4-thiadiazol-2-amine?
The InChIKey is WUGDQWAFIOTXTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10FN3S/c1-6(2,3-7)4-9-10-5(8)11-4/h3H2,1-2H3,(H2,8,10).
What are the key properties of 5-(1-fluoro-2-methylpropan-2-yl)-1,3,4-thiadiazol-2-amine?
5-(1-fluoro-2-methylpropan-2-yl)-1,3,4-thiadiazol-2-amine has a molecular weight of 175.23 g/mol, XLogP of 1.37, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-fluoro-2-methylpropan-2-yl)-1,3,4-thiadiazol-2-amine is sourced from PubChem (CID 71407066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).