2,2-difluoro-N-(thiadiazol-4-ylmethyl)cyclopentan-1-amine

C8H11F2N3S — CID 131086463

IUPAC2,2-difluoro-N-(thiadiazol-4-ylmethyl)cyclopentan-1-amine
SMILESFC1(F)CCCC1NCc1csnn1
InChIInChI=1S/C8H11F2N3S/c9-8(10)3-1-2-7(8)11-4-6-5-14-13-12-6/h5,7,11H,1-4H2
InChIKeyNQPKEIDGZQSXRA-UHFFFAOYSA-N
MW219.26 g/mol
LogP1.82
Rot. Bonds3

About 2,2-difluoro-N-(thiadiazol-4-ylmethyl)cyclopentan-1-amine

2,2-difluoro-N-(thiadiazol-4-ylmethyl)cyclopentan-1-amine (PubChem CID 131086463) has the molecular formula C8H11F2N3S and a molecular weight of 219.26 g/mol. Its IUPAC name is 2,2-difluoro-N-(thiadiazol-4-ylmethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name2,2-difluoro-N-(thiadiazol-4-ylmethyl)cyclopentan-1-amine
PubChem CID131086463
Molecular FormulaC8H11F2N3S
Molecular Weight219.26 g/mol
Exact Mass219.06
IUPAC Name2,2-difluoro-N-(thiadiazol-4-ylmethyl)cyclopentan-1-amine
SMILESFC1(F)CCCC1NCc1csnn1
InChIInChI=1S/C8H11F2N3S/c9-8(10)3-1-2-7(8)11-4-6-5-14-13-12-6/h5,7,11H,1-4H2
InChIKeyNQPKEIDGZQSXRA-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

Analyze 2,2-difluoro-N-(thiadiazol-4-ylmethyl)cyclopentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N-(thiadiazol-4-ylmethyl)cyclopentan-1-amine?
The IUPAC name of 2,2-difluoro-N-(thiadiazol-4-ylmethyl)cyclopentan-1-amine (CID 131086463) is 2,2-difluoro-N-(thiadiazol-4-ylmethyl)cyclopentan-1-amine.
What is the SMILES notation for 2,2-difluoro-N-(thiadiazol-4-ylmethyl)cyclopentan-1-amine?
The canonical SMILES for 2,2-difluoro-N-(thiadiazol-4-ylmethyl)cyclopentan-1-amine is FC1(F)CCCC1NCc1csnn1.
What is the InChIKey of 2,2-difluoro-N-(thiadiazol-4-ylmethyl)cyclopentan-1-amine?
The InChIKey is NQPKEIDGZQSXRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F2N3S/c9-8(10)3-1-2-7(8)11-4-6-5-14-13-12-6/h5,7,11H,1-4H2.
What are the key properties of 2,2-difluoro-N-(thiadiazol-4-ylmethyl)cyclopentan-1-amine?
2,2-difluoro-N-(thiadiazol-4-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 2,2-difluoro-N-(thiadiazol-4-ylmethyl)cyclopentan-1-amine is sourced from PubChem (CID 131086463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).