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

C5H7N3S — CID 65268891

IUPACN-cyclopropyl-1,2,4-thiadiazol-5-amine
SMILESc1nsc(NC2CC2)n1
InChIInChI=1S/C5H7N3S/c1-2-4(1)8-5-6-3-7-9-5/h3-4H,1-2H2,(H,6,7,8)
InChIKeyUXNSFGJFOGKPRC-UHFFFAOYSA-N
MW141.20 g/mol
LogP1.11
Rot. Bonds2

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

N-cyclopropyl-1,2,4-thiadiazol-5-amine (PubChem CID 65268891) has the molecular formula C5H7N3S and a molecular weight of 141.20 g/mol. Its IUPAC name is N-cyclopropyl-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound NameN-cyclopropyl-1,2,4-thiadiazol-5-amine
PubChem CID65268891
Molecular FormulaC5H7N3S
Molecular Weight141.20 g/mol
Exact Mass141.04
IUPAC NameN-cyclopropyl-1,2,4-thiadiazol-5-amine
SMILESc1nsc(NC2CC2)n1
InChIInChI=1S/C5H7N3S/c1-2-4(1)8-5-6-3-7-9-5/h3-4H,1-2H2,(H,6,7,8)
InChIKeyUXNSFGJFOGKPRC-UHFFFAOYSA-N
XLogP1.11
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.20
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,3,3-trifluoropropyl)-1,2,4-thiadiazol-5-amine
CID 65274380
N-(4,4,4-trifluorobutan-2-yl)-1,2,4-thiadiazol-5-amine
CID 104854570
N-[1-(trifluoromethyl)cyclopropyl]-1,2,4-thiadiazol-5-amine
CID 106214891
N-(4-fluorobutyl)-1,2,4-thiadiazol-5-amine
CID 130592971
N-(3-fluorocyclopentyl)-1,2,4-thiadiazol-5-amine
CID 130742298
N-(4,4-difluorobutan-2-yl)-1,2,4-thiadiazol-5-amine
CID 130831786
N-(1,1,1-trifluoropropan-2-yl)-1,2,4-thiadiazol-5-amine
CID 130848375
N-(3-fluorobutyl)-1,2,4-thiadiazol-5-amine
CID 131160593
N-[(1S,2R)-2-fluorocyclopentyl]-1,2,4-thiadiazol-5-amine
CID 131185858
3-(3-Aminopropylamino)-1,2,4-thiadiazole
CID 20557655
N-ethyl-1,2,4-thiadiazol-5-amine
CID 55286483
N-ethyl-1,2,4-thiadiazol-3-amine
CID 57179512

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1,2,4-thiadiazol-5-amine?
The IUPAC name of N-cyclopropyl-1,2,4-thiadiazol-5-amine (CID 65268891) is N-cyclopropyl-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for N-cyclopropyl-1,2,4-thiadiazol-5-amine?
The canonical SMILES for N-cyclopropyl-1,2,4-thiadiazol-5-amine is c1nsc(NC2CC2)n1.
What is the InChIKey of N-cyclopropyl-1,2,4-thiadiazol-5-amine?
The InChIKey is UXNSFGJFOGKPRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3S/c1-2-4(1)8-5-6-3-7-9-5/h3-4H,1-2H2,(H,6,7,8).
What are the key properties of N-cyclopropyl-1,2,4-thiadiazol-5-amine?
N-cyclopropyl-1,2,4-thiadiazol-5-amine has a molecular weight of 141.20 g/mol, XLogP of 1.11, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 65268891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).