2-[5-(2-methylcyclopentyl)-1,3,4-thiadiazol-2-yl]ethanamine

C10H17N3S — CID 107185489

IUPAC2-[5-(2-methylcyclopentyl)-1,3,4-thiadiazol-2-yl]ethanamine
SMILESCC1CCCC1c1nnc(CCN)s1
InChIInChI=1S/C10H17N3S/c1-7-3-2-4-8(7)10-13-12-9(14-10)5-6-11/h7-8H,2-6,11H2,1H3
InChIKeyXZZTVVXJVUGYAH-UHFFFAOYSA-N
MW211.33 g/mol
LogP1.94
Rot. Bonds3

About 2-[5-(2-methylcyclopentyl)-1,3,4-thiadiazol-2-yl]ethanamine

2-[5-(2-methylcyclopentyl)-1,3,4-thiadiazol-2-yl]ethanamine (PubChem CID 107185489) has the molecular formula C10H17N3S and a molecular weight of 211.33 g/mol. Its IUPAC name is 2-[5-(2-methylcyclopentyl)-1,3,4-thiadiazol-2-yl]ethanamine.

Molecular Properties

Compound Name2-[5-(2-methylcyclopentyl)-1,3,4-thiadiazol-2-yl]ethanamine
PubChem CID107185489
Molecular FormulaC10H17N3S
Molecular Weight211.33 g/mol
Exact Mass211.11
IUPAC Name2-[5-(2-methylcyclopentyl)-1,3,4-thiadiazol-2-yl]ethanamine
SMILESCC1CCCC1c1nnc(CCN)s1
InChIInChI=1S/C10H17N3S/c1-7-3-2-4-8(7)10-13-12-9(14-10)5-6-11/h7-8H,2-6,11H2,1H3
InChIKeyXZZTVVXJVUGYAH-UHFFFAOYSA-N
XLogP1.94
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[5-(thian-2-yl)-1,3,4-thiadiazol-2-yl]ethanamine
CID 80596034
5-(2-aminoethyl)-N-cycloheptyl-1,3,4-thiadiazol-2-amine
CID 82477350
1-[5-(2-methylcyclopentyl)-1,3,4-thiadiazol-2-yl]-N-propylpropan-1-amine
CID 107185648
N-ethyl-2-[5-(3-methyloxan-4-yl)-1,3,4-thiadiazol-2-yl]ethanamine
CID 114241799
N-(2,6-dimethylcyclohexyl)-5-ethyl-1,3,4-thiadiazol-2-amine
CID 107647648
5-ethyl-N-(2-methylcyclopentyl)-1,3,4-thiadiazol-2-amine
CID 107647698
2-(2-chloroethyl)-5-(2,2-dimethylcyclopentyl)-1,3,4-thiadiazole
CID 107185456
N-(2,6-dimethylcyclohexyl)-5-(2-methylpropyl)-1,3,4-thiadiazol-2-amine
CID 114165428
3-[5-(3,3-difluorocyclohexyl)-1,3,4-thiadiazol-2-yl]propan-1-amine
CID 114226756
[4-methyl-5-(2-methylcyclopentyl)-1,2,4-triazol-3-yl]methanamine
CID 107186492
N-(2-methylcyclopentyl)-5-(2-methylpropyl)-1,3,4-thiadiazol-2-amine
CID 106260329
5-(chloromethyl)-2-(2-methylcyclohexyl)-1,3-thiazole
CID 131182425

Frequently Asked Questions

What is the IUPAC name of 2-[5-(2-methylcyclopentyl)-1,3,4-thiadiazol-2-yl]ethanamine?
The IUPAC name of 2-[5-(2-methylcyclopentyl)-1,3,4-thiadiazol-2-yl]ethanamine (CID 107185489) is 2-[5-(2-methylcyclopentyl)-1,3,4-thiadiazol-2-yl]ethanamine.
What is the SMILES notation for 2-[5-(2-methylcyclopentyl)-1,3,4-thiadiazol-2-yl]ethanamine?
The canonical SMILES for 2-[5-(2-methylcyclopentyl)-1,3,4-thiadiazol-2-yl]ethanamine is CC1CCCC1c1nnc(CCN)s1.
What is the InChIKey of 2-[5-(2-methylcyclopentyl)-1,3,4-thiadiazol-2-yl]ethanamine?
The InChIKey is XZZTVVXJVUGYAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3S/c1-7-3-2-4-8(7)10-13-12-9(14-10)5-6-11/h7-8H,2-6,11H2,1H3.
What are the key properties of 2-[5-(2-methylcyclopentyl)-1,3,4-thiadiazol-2-yl]ethanamine?
2-[5-(2-methylcyclopentyl)-1,3,4-thiadiazol-2-yl]ethanamine has a molecular weight of 211.33 g/mol, XLogP of 1.94, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(2-methylcyclopentyl)-1,3,4-thiadiazol-2-yl]ethanamine is sourced from PubChem (CID 107185489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).