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

C8H14N4OS — CID 66278140

IUPAC2-[[(3-amino-1,2,4-thiadiazol-5-yl)amino]methyl]cyclopentan-1-ol
SMILESNc1nsc(NCC2CCCC2O)n1
InChIInChI=1S/C8H14N4OS/c9-7-11-8(14-12-7)10-4-5-2-1-3-6(5)13/h5-6,13H,1-4H2,(H3,9,10,11,12)
InChIKeySFJMACIICAIQQE-UHFFFAOYSA-N
MW214.29 g/mol
LogP0.69
Rot. Bonds3

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

2-[[(3-amino-1,2,4-thiadiazol-5-yl)amino]methyl]cyclopentan-1-ol (PubChem CID 66278140) has the molecular formula C8H14N4OS and a molecular weight of 214.29 g/mol. Its IUPAC name is 2-[[(3-amino-1,2,4-thiadiazol-5-yl)amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[[(3-amino-1,2,4-thiadiazol-5-yl)amino]methyl]cyclopentan-1-ol
PubChem CID66278140
Molecular FormulaC8H14N4OS
Molecular Weight214.29 g/mol
Exact Mass214.09
IUPAC Name2-[[(3-amino-1,2,4-thiadiazol-5-yl)amino]methyl]cyclopentan-1-ol
SMILESNc1nsc(NCC2CCCC2O)n1
InChIInChI=1S/C8H14N4OS/c9-7-11-8(14-12-7)10-4-5-2-1-3-6(5)13/h5-6,13H,1-4H2,(H3,9,10,11,12)
InChIKeySFJMACIICAIQQE-UHFFFAOYSA-N
XLogP0.69
TPSA84.06 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.29
LogP ≤ 50.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

5-N-(2-bicyclo[2.2.1]heptanylmethyl)-1,2,4-thiadiazole-3,5-diamine
CID 66278129
2-[[(2-aminopyrimidin-4-yl)amino]methyl]cyclopentan-1-ol
CID 80856454
5-N-(oxan-3-ylmethyl)-1,2,4-thiadiazole-3,5-diamine
CID 66281185
2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol
CID 83153384
2-[[(4-ethyl-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol
CID 64911049
5-N-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethyl)-1,2,4-thiadiazole-3,5-diamine
CID 66278553
2-[[(5-amino-3-pyridinyl)amino]methyl]cyclopentan-1-ol
CID 104535099
2-[[(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]methyl]cyclopentan-1-ol
CID 103328656
5-N-(2-cyclohexyloxyethyl)-1,2,4-thiadiazole-3,5-diamine
CID 66278347
N-[(2-aminocyclohexyl)methyl]-3-tert-butyl-1,2,4-thiadiazol-5-amine
CID 65278010
1-[[(3-amino-1,2,4-thiadiazol-5-yl)amino]methyl]cyclopentan-1-ol
CID 66277916
2-[(4-aminoanilino)methyl]cyclohexan-1-ol
CID 64930000

Frequently Asked Questions

What is the IUPAC name of 2-[[(3-amino-1,2,4-thiadiazol-5-yl)amino]methyl]cyclopentan-1-ol?
The IUPAC name of 2-[[(3-amino-1,2,4-thiadiazol-5-yl)amino]methyl]cyclopentan-1-ol (CID 66278140) is 2-[[(3-amino-1,2,4-thiadiazol-5-yl)amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 2-[[(3-amino-1,2,4-thiadiazol-5-yl)amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 2-[[(3-amino-1,2,4-thiadiazol-5-yl)amino]methyl]cyclopentan-1-ol is Nc1nsc(NCC2CCCC2O)n1.
What is the InChIKey of 2-[[(3-amino-1,2,4-thiadiazol-5-yl)amino]methyl]cyclopentan-1-ol?
The InChIKey is SFJMACIICAIQQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4OS/c9-7-11-8(14-12-7)10-4-5-2-1-3-6(5)13/h5-6,13H,1-4H2,(H3,9,10,11,12).
What are the key properties of 2-[[(3-amino-1,2,4-thiadiazol-5-yl)amino]methyl]cyclopentan-1-ol?
2-[[(3-amino-1,2,4-thiadiazol-5-yl)amino]methyl]cyclopentan-1-ol has a molecular weight of 214.29 g/mol, XLogP of 0.69, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(3-amino-1,2,4-thiadiazol-5-yl)amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 66278140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).