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

C9H15N3OS — CID 103269830

IUPAC3-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]methyl]cyclopentan-1-ol
SMILESCc1nnc(NCC2CCC(O)C2)s1
InChIInChI=1S/C9H15N3OS/c1-6-11-12-9(14-6)10-5-7-2-3-8(13)4-7/h7-8,13H,2-5H2,1H3,(H,10,12)
InChIKeyOXWZHGGQLRFYLO-UHFFFAOYSA-N
MW213.31 g/mol
LogP1.42
Rot. Bonds3

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

3-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]methyl]cyclopentan-1-ol (PubChem CID 103269830) has the molecular formula C9H15N3OS and a molecular weight of 213.31 g/mol. Its IUPAC name is 3-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]methyl]cyclopentan-1-ol
PubChem CID103269830
Molecular FormulaC9H15N3OS
Molecular Weight213.31 g/mol
Exact Mass213.09
IUPAC Name3-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]methyl]cyclopentan-1-ol
SMILESCc1nnc(NCC2CCC(O)C2)s1
InChIInChI=1S/C9H15N3OS/c1-6-11-12-9(14-6)10-5-7-2-3-8(13)4-7/h7-8,13H,2-5H2,1H3,(H,10,12)
InChIKeyOXWZHGGQLRFYLO-UHFFFAOYSA-N
XLogP1.42
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.31
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 65209321
N-(cycloheptylmethyl)-5-methyl-1,3,4-thiadiazol-2-amine
CID 107648211
5-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 65209104
4-[[(5-bromo-1,3,4-thiadiazol-2-yl)amino]methyl]cyclohexan-1-ol
CID 106137434
5-methyl-N-(oxolan-2-ylmethyl)-1,3,4-thiadiazol-2-amine
CID 64915572
3-[[(3-propyl-1,2,4-thiadiazol-5-yl)amino]methyl]cyclopentan-1-ol
CID 106128094
3-[[(4-methyl-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol
CID 106129708
3-[[(4,5-dimethyl-1,3-thiazol-2-yl)amino]methyl]cyclobutan-1-ol
CID 66005707
3-[(4,5-dihydro-1H-imidazol-2-ylamino)methyl]cyclopentan-1-ol
CID 103207403
N-(cyclopropylmethyl)-5-propan-2-yl-1,3,4-thiadiazol-2-amine
CID 130685931
3-[[(6-amino-1,3-benzothiazol-2-yl)amino]methyl]cyclopentan-1-ol
CID 106119520
methyl 2-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]methyl]cyclohexane-1-carboxylate
CID 108778241

Frequently Asked Questions

What is the IUPAC name of 3-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]methyl]cyclopentan-1-ol?
The IUPAC name of 3-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]methyl]cyclopentan-1-ol (CID 103269830) is 3-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 3-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 3-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]methyl]cyclopentan-1-ol is Cc1nnc(NCC2CCC(O)C2)s1.
What is the InChIKey of 3-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]methyl]cyclopentan-1-ol?
The InChIKey is OXWZHGGQLRFYLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3OS/c1-6-11-12-9(14-6)10-5-7-2-3-8(13)4-7/h7-8,13H,2-5H2,1H3,(H,10,12).
What are the key properties of 3-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]methyl]cyclopentan-1-ol?
3-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]methyl]cyclopentan-1-ol has a molecular weight of 213.31 g/mol, XLogP of 1.42, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 103269830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).