N-(2-cyclohexylethyl)-1,2,4-thiadiazol-5-amine

C10H17N3S — CID 65271577

IUPACN-(2-cyclohexylethyl)-1,2,4-thiadiazol-5-amine
SMILESc1nsc(NCCC2CCCCC2)n1
InChIInChI=1S/C10H17N3S/c1-2-4-9(5-3-1)6-7-11-10-12-8-13-14-10/h8-9H,1-7H2,(H,11,12,13)
InChIKeyGCTIPPSEVZXJLA-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.92
Rot. Bonds4

About N-(2-cyclohexylethyl)-1,2,4-thiadiazol-5-amine

N-(2-cyclohexylethyl)-1,2,4-thiadiazol-5-amine (PubChem CID 65271577) has the molecular formula C10H17N3S and a molecular weight of 211.33 g/mol. Its IUPAC name is N-(2-cyclohexylethyl)-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound NameN-(2-cyclohexylethyl)-1,2,4-thiadiazol-5-amine
PubChem CID65271577
Molecular FormulaC10H17N3S
Molecular Weight211.33 g/mol
Exact Mass211.11
IUPAC NameN-(2-cyclohexylethyl)-1,2,4-thiadiazol-5-amine
SMILESc1nsc(NCCC2CCCCC2)n1
InChIInChI=1S/C10H17N3S/c1-2-4-9(5-3-1)6-7-11-10-12-8-13-14-10/h8-9H,1-7H2,(H,11,12,13)
InChIKeyGCTIPPSEVZXJLA-UHFFFAOYSA-N
XLogP2.92
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(1-fluorocyclobutyl)ethyl]-1,2,4-thiadiazol-5-amine
CID 130616600
N-(2,3-dimethylcyclohexyl)-1,2,4-thiadiazol-5-amine
CID 65271257
N-[(4-ethylcyclohexyl)methyl]-1,2,4-thiadiazol-5-amine
CID 65271294
N-(3-methylcyclohexyl)-1,2,4-thiadiazol-5-amine
CID 65271443
N-(2-cyclopentylethyl)-1,2,4-thiadiazol-5-amine
CID 65271516
N-(2-methylcyclohexyl)-1,2,4-thiadiazol-5-amine
CID 65271545
N-(cyclopentylmethyl)-1,2,4-thiadiazol-5-amine
CID 65271554
N-(cyclohexylmethyl)-1,2,4-thiadiazol-5-amine
CID 65271613
N-(4-methylpentyl)-1,2,4-thiadiazol-5-amine
CID 65271648
N-cyclooctyl-1,2,4-thiadiazol-5-amine
CID 65271652
N-(4-methylcyclohexyl)-1,2,4-thiadiazol-5-amine
CID 65271662
N-(4-methylpentan-2-yl)-1,2,4-thiadiazol-5-amine
CID 65271727

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylethyl)-1,2,4-thiadiazol-5-amine?
The IUPAC name of N-(2-cyclohexylethyl)-1,2,4-thiadiazol-5-amine (CID 65271577) is N-(2-cyclohexylethyl)-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for N-(2-cyclohexylethyl)-1,2,4-thiadiazol-5-amine?
The canonical SMILES for N-(2-cyclohexylethyl)-1,2,4-thiadiazol-5-amine is c1nsc(NCCC2CCCCC2)n1.
What is the InChIKey of N-(2-cyclohexylethyl)-1,2,4-thiadiazol-5-amine?
The InChIKey is GCTIPPSEVZXJLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3S/c1-2-4-9(5-3-1)6-7-11-10-12-8-13-14-10/h8-9H,1-7H2,(H,11,12,13).
What are the key properties of N-(2-cyclohexylethyl)-1,2,4-thiadiazol-5-amine?
N-(2-cyclohexylethyl)-1,2,4-thiadiazol-5-amine has a molecular weight of 211.33 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylethyl)-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 65271577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).