3,3-difluoro-N-(1,2,5-thiadiazol-3-ylmethyl)cyclopentan-1-amine

C8H11F2N3S — CID 130857599

IUPAC3,3-difluoro-N-(1,2,5-thiadiazol-3-ylmethyl)cyclopentan-1-amine
SMILESFC1(F)CCC(NCc2cnsn2)C1
InChIInChI=1S/C8H11F2N3S/c9-8(10)2-1-6(3-8)11-4-7-5-12-14-13-7/h5-6,11H,1-4H2
InChIKeyQSLILPQMGUEDJE-UHFFFAOYSA-N
MW219.26 g/mol
LogP1.82
Rot. Bonds3

About 3,3-difluoro-N-(1,2,5-thiadiazol-3-ylmethyl)cyclopentan-1-amine

3,3-difluoro-N-(1,2,5-thiadiazol-3-ylmethyl)cyclopentan-1-amine (PubChem CID 130857599) has the molecular formula C8H11F2N3S and a molecular weight of 219.26 g/mol. Its IUPAC name is 3,3-difluoro-N-(1,2,5-thiadiazol-3-ylmethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name3,3-difluoro-N-(1,2,5-thiadiazol-3-ylmethyl)cyclopentan-1-amine
PubChem CID130857599
Molecular FormulaC8H11F2N3S
Molecular Weight219.26 g/mol
Exact Mass219.06
IUPAC Name3,3-difluoro-N-(1,2,5-thiadiazol-3-ylmethyl)cyclopentan-1-amine
SMILESFC1(F)CCC(NCc2cnsn2)C1
InChIInChI=1S/C8H11F2N3S/c9-8(10)2-1-6(3-8)11-4-7-5-12-14-13-7/h5-6,11H,1-4H2
InChIKeyQSLILPQMGUEDJE-UHFFFAOYSA-N
XLogP1.82
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.26
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(1,2,5-thiadiazol-3-ylmethylamino)piperidin-2-one
CID 130986202
4,4-difluoro-N-(pyridin-3-ylmethyl)cyclohexan-1-amine
CID 126787190
N-(2,2-difluoroethyl)-3,3-difluorocyclopentan-1-amine
CID 130831231
N-(3,3-difluorocyclopentyl)-5-methyl-1,3-thiazol-2-amine
CID 131160277
N-[(1-aminocyclobutyl)methyl]-3,3-difluorocyclopentan-1-amine
CID 130654103
3-[[1-(chloromethyl)cyclobutyl]methyl]-1,2,5-thiadiazole
CID 130871474
4,4-difluoro-N-(1H-imidazol-2-ylmethyl)cyclohexan-1-amine
CID 126782159
4-(1,2,5-thiadiazol-3-ylmethyl)piperidin-4-ol
CID 130871486
1-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-(1,2,5-thiadiazol-3-ylmethyl)urea
CID 166310944
methyl 3-(1,2,5-thiadiazol-3-ylmethylamino)adamantane-1-carboxylate
CID 136571900
N-(3,3-difluorocyclopentyl)aniline
CID 170406665
N-methyl-3-(1,2,5-thiadiazol-3-ylmethyl)cyclohexan-1-amine
CID 131003106

Frequently Asked Questions

What is the IUPAC name of 3,3-difluoro-N-(1,2,5-thiadiazol-3-ylmethyl)cyclopentan-1-amine?
The IUPAC name of 3,3-difluoro-N-(1,2,5-thiadiazol-3-ylmethyl)cyclopentan-1-amine (CID 130857599) is 3,3-difluoro-N-(1,2,5-thiadiazol-3-ylmethyl)cyclopentan-1-amine.
What is the SMILES notation for 3,3-difluoro-N-(1,2,5-thiadiazol-3-ylmethyl)cyclopentan-1-amine?
The canonical SMILES for 3,3-difluoro-N-(1,2,5-thiadiazol-3-ylmethyl)cyclopentan-1-amine is FC1(F)CCC(NCc2cnsn2)C1.
What is the InChIKey of 3,3-difluoro-N-(1,2,5-thiadiazol-3-ylmethyl)cyclopentan-1-amine?
The InChIKey is QSLILPQMGUEDJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F2N3S/c9-8(10)2-1-6(3-8)11-4-7-5-12-14-13-7/h5-6,11H,1-4H2.
What are the key properties of 3,3-difluoro-N-(1,2,5-thiadiazol-3-ylmethyl)cyclopentan-1-amine?
3,3-difluoro-N-(1,2,5-thiadiazol-3-ylmethyl)cyclopentan-1-amine has a molecular weight of 219.26 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoro-N-(1,2,5-thiadiazol-3-ylmethyl)cyclopentan-1-amine is sourced from PubChem (CID 130857599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).