[1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexyl]methanol

C10H17N3OS — CID 65209442

IUPAC[1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexyl]methanol
SMILESCc1nnc(NC2(CO)CCCCC2)s1
InChIInChI=1S/C10H17N3OS/c1-8-12-13-9(15-8)11-10(7-14)5-3-2-4-6-10/h14H,2-7H2,1H3,(H,11,13)
InChIKeyBBQOEHBMBIAJFH-UHFFFAOYSA-N
MW227.33 g/mol
LogP1.95
Rot. Bonds3

About [1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexyl]methanol

[1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexyl]methanol (PubChem CID 65209442) has the molecular formula C10H17N3OS and a molecular weight of 227.33 g/mol. Its IUPAC name is [1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexyl]methanol
PubChem CID65209442
Molecular FormulaC10H17N3OS
Molecular Weight227.33 g/mol
Exact Mass227.11
IUPAC Name[1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexyl]methanol
SMILESCc1nnc(NC2(CO)CCCCC2)s1
InChIInChI=1S/C10H17N3OS/c1-8-12-13-9(15-8)11-10(7-14)5-3-2-4-6-10/h14H,2-7H2,1H3,(H,11,13)
InChIKeyBBQOEHBMBIAJFH-UHFFFAOYSA-N
XLogP1.95
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.33
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclopentyl]methanol
CID 65209440
[1-[[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]amino]cyclobutyl]methanol
CID 114448761
[1-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]cyclohexyl]methanol
CID 65276919
[1-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]cyclobutyl]methanol
CID 115886146
[1-(4-methylanilino)cycloheptyl]methanol
CID 61044779
5-methyl-N-[1-(trifluoromethyl)cyclopropyl]-1,3,4-thiadiazol-2-amine
CID 106214902
4-ethyl-1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexane-1-carboxylic acid
CID 65209360
2-[1-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]methyl]cyclopropyl]ethanol
CID 114749612
2-[1-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]methyl]cyclobutyl]acetic acid
CID 81160973
[3-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]methyl]oxetan-3-yl]methanol
CID 130662949
[1-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclobutyl]methanol
CID 114448760
[1-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]cyclohexyl]methanol
CID 80919373

Frequently Asked Questions

What is the IUPAC name of [1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexyl]methanol?
The IUPAC name of [1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexyl]methanol (CID 65209442) is [1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexyl]methanol.
What is the SMILES notation for [1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexyl]methanol?
The canonical SMILES for [1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexyl]methanol is Cc1nnc(NC2(CO)CCCCC2)s1.
What is the InChIKey of [1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexyl]methanol?
The InChIKey is BBQOEHBMBIAJFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3OS/c1-8-12-13-9(15-8)11-10(7-14)5-3-2-4-6-10/h14H,2-7H2,1H3,(H,11,13).
What are the key properties of [1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexyl]methanol?
[1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexyl]methanol has a molecular weight of 227.33 g/mol, XLogP of 1.95, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexyl]methanol is sourced from PubChem (CID 65209442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).