2-[(5-bromo-1,3,4-thiadiazol-2-yl)amino]cyclopentan-1-ol

C7H10BrN3OS — CID 130991530

IUPAC2-[(5-bromo-1,3,4-thiadiazol-2-yl)amino]cyclopentan-1-ol
SMILESOC1CCCC1Nc1nnc(Br)s1
InChIInChI=1S/C7H10BrN3OS/c8-6-10-11-7(13-6)9-4-2-1-3-5(4)12/h4-5,12H,1-3H2,(H,9,11)
InChIKeyKDWYVUDNWGOSBU-UHFFFAOYSA-N
MW264.15 g/mol
LogP1.63
Rot. Bonds2

About 2-[(5-bromo-1,3,4-thiadiazol-2-yl)amino]cyclopentan-1-ol

2-[(5-bromo-1,3,4-thiadiazol-2-yl)amino]cyclopentan-1-ol (PubChem CID 130991530) has the molecular formula C7H10BrN3OS and a molecular weight of 264.15 g/mol. Its IUPAC name is 2-[(5-bromo-1,3,4-thiadiazol-2-yl)amino]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[(5-bromo-1,3,4-thiadiazol-2-yl)amino]cyclopentan-1-ol
PubChem CID130991530
Molecular FormulaC7H10BrN3OS
Molecular Weight264.15 g/mol
Exact Mass262.97
IUPAC Name2-[(5-bromo-1,3,4-thiadiazol-2-yl)amino]cyclopentan-1-ol
SMILESOC1CCCC1Nc1nnc(Br)s1
InChIInChI=1S/C7H10BrN3OS/c8-6-10-11-7(13-6)9-4-2-1-3-5(4)12/h4-5,12H,1-3H2,(H,9,11)
InChIKeyKDWYVUDNWGOSBU-UHFFFAOYSA-N
XLogP1.63
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.15
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

trans-(1R,2R)-2-(2,4,6-tribromoanilino)cyclopentan-1-ol
CID 102733064
5-bromo-N-(cyclobutylmethyl)-1,3,4-thiadiazol-2-amine
CID 64624511
trans-(1S,2S)-2-[(5-bromo-3-pyridinyl)amino]cyclopentan-1-ol
CID 99857915
2-[(3-methylpyrazin-2-yl)amino]cyclopentan-1-ol
CID 127002045
2-[(4-ethyl-1,3-thiazol-2-yl)amino]cyclohexan-1-ol
CID 62961190
trans-(1S,2S)-2-(5-bromo-2,4-difluoroanilino)cyclopentan-1-ol
CID 102853369
trans-(1R,2R)-2-(3-bromoanilino)cyclopentan-1-ol
CID 102733003
5-bromo-N-(1,1-dioxothietan-3-yl)-1,3,4-thiadiazol-2-amine
CID 130921490
trans-(1S,2S)-2-[(5-bromo-2-pyridinyl)amino]cyclohexan-1-ol
CID 119031585
2-(2,4,6-tribromoanilino)cycloheptan-1-ol
CID 63489385
2-[(5-bromo-2-hydrazinylpyrimidin-4-yl)amino]cyclohexan-1-ol
CID 80919191
2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol
CID 91648836

Frequently Asked Questions

What is the IUPAC name of 2-[(5-bromo-1,3,4-thiadiazol-2-yl)amino]cyclopentan-1-ol?
The IUPAC name of 2-[(5-bromo-1,3,4-thiadiazol-2-yl)amino]cyclopentan-1-ol (CID 130991530) is 2-[(5-bromo-1,3,4-thiadiazol-2-yl)amino]cyclopentan-1-ol.
What is the SMILES notation for 2-[(5-bromo-1,3,4-thiadiazol-2-yl)amino]cyclopentan-1-ol?
The canonical SMILES for 2-[(5-bromo-1,3,4-thiadiazol-2-yl)amino]cyclopentan-1-ol is OC1CCCC1Nc1nnc(Br)s1.
What is the InChIKey of 2-[(5-bromo-1,3,4-thiadiazol-2-yl)amino]cyclopentan-1-ol?
The InChIKey is KDWYVUDNWGOSBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10BrN3OS/c8-6-10-11-7(13-6)9-4-2-1-3-5(4)12/h4-5,12H,1-3H2,(H,9,11).
What are the key properties of 2-[(5-bromo-1,3,4-thiadiazol-2-yl)amino]cyclopentan-1-ol?
2-[(5-bromo-1,3,4-thiadiazol-2-yl)amino]cyclopentan-1-ol has a molecular weight of 264.15 g/mol, XLogP of 1.63, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-bromo-1,3,4-thiadiazol-2-yl)amino]cyclopentan-1-ol is sourced from PubChem (CID 130991530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).