5,5,5-trifluoro-N-propyl-1-(thiadiazol-4-yl)pentan-1-amine

C10H16F3N3S — CID 105174293

IUPAC5,5,5-trifluoro-N-propyl-1-(thiadiazol-4-yl)pentan-1-amine
SMILESCCCNC(CCCC(F)(F)F)c1csnn1
InChIInChI=1S/C10H16F3N3S/c1-2-6-14-8(9-7-17-16-15-9)4-3-5-10(11,12)13/h7-8,14H,2-6H2,1H3
InChIKeyDACPKPMHCXSDJG-UHFFFAOYSA-N
MW267.32 g/mol
LogP3.31
Rot. Bonds7

About 5,5,5-trifluoro-N-propyl-1-(thiadiazol-4-yl)pentan-1-amine

5,5,5-trifluoro-N-propyl-1-(thiadiazol-4-yl)pentan-1-amine (PubChem CID 105174293) has the molecular formula C10H16F3N3S and a molecular weight of 267.32 g/mol. Its IUPAC name is 5,5,5-trifluoro-N-propyl-1-(thiadiazol-4-yl)pentan-1-amine.

Molecular Properties

Compound Name5,5,5-trifluoro-N-propyl-1-(thiadiazol-4-yl)pentan-1-amine
PubChem CID105174293
Molecular FormulaC10H16F3N3S
Molecular Weight267.32 g/mol
Exact Mass267.10
IUPAC Name5,5,5-trifluoro-N-propyl-1-(thiadiazol-4-yl)pentan-1-amine
SMILESCCCNC(CCCC(F)(F)F)c1csnn1
InChIInChI=1S/C10H16F3N3S/c1-2-6-14-8(9-7-17-16-15-9)4-3-5-10(11,12)13/h7-8,14H,2-6H2,1H3
InChIKeyDACPKPMHCXSDJG-UHFFFAOYSA-N
XLogP3.31
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.32
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4,4,4-trifluoro-N-methyl-1-(thiadiazol-4-yl)butan-1-amine
CID 105156255
4,4,4-Trifluoro-1-(thiadiazol-4-yl)butan-1-amine
CID 105156282
4,4,4-trifluoro-N-propyl-1-(thiadiazol-4-yl)butan-1-amine
CID 105156307
N-ethyl-4,4,4-trifluoro-1-(thiadiazol-4-yl)butan-1-amine
CID 105156392
5,5,5-trifluoro-N-methyl-1-(thiadiazol-4-yl)pentan-1-amine
CID 105174244
5,5,5-Trifluoro-1-(thiadiazol-4-yl)pentan-1-amine
CID 105174271
N-ethyl-5,5,5-trifluoro-1-(thiadiazol-4-yl)pentan-1-amine
CID 105174383
2-(3,3-difluorocyclopentyl)-N-ethyl-1-(thiadiazol-4-yl)ethanamine
CID 114225771
2-(3,3-difluorocyclohexyl)-N-ethyl-1-(thiadiazol-4-yl)ethanamine
CID 114225862
5,5,5-trifluoro-N-(thiadiazol-4-ylmethyl)pentan-1-amine
CID 115516815
4-(2-Fluoro-2-pyrrolidin-2-ylethyl)thiadiazole
CID 126980924
4-(2-Fluoro-2-piperidin-2-ylethyl)thiadiazole
CID 130550529

Frequently Asked Questions

What is the IUPAC name of 5,5,5-trifluoro-N-propyl-1-(thiadiazol-4-yl)pentan-1-amine?
The IUPAC name of 5,5,5-trifluoro-N-propyl-1-(thiadiazol-4-yl)pentan-1-amine (CID 105174293) is 5,5,5-trifluoro-N-propyl-1-(thiadiazol-4-yl)pentan-1-amine.
What is the SMILES notation for 5,5,5-trifluoro-N-propyl-1-(thiadiazol-4-yl)pentan-1-amine?
The canonical SMILES for 5,5,5-trifluoro-N-propyl-1-(thiadiazol-4-yl)pentan-1-amine is CCCNC(CCCC(F)(F)F)c1csnn1.
What is the InChIKey of 5,5,5-trifluoro-N-propyl-1-(thiadiazol-4-yl)pentan-1-amine?
The InChIKey is DACPKPMHCXSDJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F3N3S/c1-2-6-14-8(9-7-17-16-15-9)4-3-5-10(11,12)13/h7-8,14H,2-6H2,1H3.
What are the key properties of 5,5,5-trifluoro-N-propyl-1-(thiadiazol-4-yl)pentan-1-amine?
5,5,5-trifluoro-N-propyl-1-(thiadiazol-4-yl)pentan-1-amine has a molecular weight of 267.32 g/mol, XLogP of 3.31, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5,5-trifluoro-N-propyl-1-(thiadiazol-4-yl)pentan-1-amine is sourced from PubChem (CID 105174293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).