N-cyclopentyl-3-cyclopropyl-1,2,4-thiadiazol-5-amine

C10H15N3S — CID 65272088

IUPACN-cyclopentyl-3-cyclopropyl-1,2,4-thiadiazol-5-amine
SMILESC1CCC(Nc2nc(C3CC3)ns2)C1
InChIInChI=1S/C10H15N3S/c1-2-4-8(3-1)11-10-12-9(13-14-10)7-5-6-7/h7-8H,1-6H2,(H,11,12,13)
InChIKeyTWJKYGXRLFNDJL-UHFFFAOYSA-N
MW209.32 g/mol
LogP2.77
Rot. Bonds3

About N-cyclopentyl-3-cyclopropyl-1,2,4-thiadiazol-5-amine

N-cyclopentyl-3-cyclopropyl-1,2,4-thiadiazol-5-amine (PubChem CID 65272088) has the molecular formula C10H15N3S and a molecular weight of 209.32 g/mol. Its IUPAC name is N-cyclopentyl-3-cyclopropyl-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound NameN-cyclopentyl-3-cyclopropyl-1,2,4-thiadiazol-5-amine
PubChem CID65272088
Molecular FormulaC10H15N3S
Molecular Weight209.32 g/mol
Exact Mass209.10
IUPAC NameN-cyclopentyl-3-cyclopropyl-1,2,4-thiadiazol-5-amine
SMILESC1CCC(Nc2nc(C3CC3)ns2)C1
InChIInChI=1S/C10H15N3S/c1-2-4-8(3-1)11-10-12-9(13-14-10)7-5-6-7/h7-8H,1-6H2,(H,11,12,13)
InChIKeyTWJKYGXRLFNDJL-UHFFFAOYSA-N
XLogP2.77
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.32
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-cyclopropyl-1,2,4-thiadiazol-5-amine?
The IUPAC name of N-cyclopentyl-3-cyclopropyl-1,2,4-thiadiazol-5-amine (CID 65272088) is N-cyclopentyl-3-cyclopropyl-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for N-cyclopentyl-3-cyclopropyl-1,2,4-thiadiazol-5-amine?
The canonical SMILES for N-cyclopentyl-3-cyclopropyl-1,2,4-thiadiazol-5-amine is C1CCC(Nc2nc(C3CC3)ns2)C1.
What is the InChIKey of N-cyclopentyl-3-cyclopropyl-1,2,4-thiadiazol-5-amine?
The InChIKey is TWJKYGXRLFNDJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3S/c1-2-4-8(3-1)11-10-12-9(13-14-10)7-5-6-7/h7-8H,1-6H2,(H,11,12,13).
What are the key properties of N-cyclopentyl-3-cyclopropyl-1,2,4-thiadiazol-5-amine?
N-cyclopentyl-3-cyclopropyl-1,2,4-thiadiazol-5-amine has a molecular weight of 209.32 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-cyclopropyl-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 65272088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).