N-(thiadiazol-5-ylmethyl)cyclopropanamine

C6H9N3S — CID 65214974

IUPACN-(thiadiazol-5-ylmethyl)cyclopropanamine
SMILESc1nnsc1CNC1CC1
InChIInChI=1S/C6H9N3S/c1-2-5(1)7-3-6-4-8-9-10-6/h4-5,7H,1-3H2
InChIKeyZMAALDIVFVQDFY-UHFFFAOYSA-N
MW155.23 g/mol
LogP0.79
Rot. Bonds3

About N-(thiadiazol-5-ylmethyl)cyclopropanamine

N-(thiadiazol-5-ylmethyl)cyclopropanamine (PubChem CID 65214974) has the molecular formula C6H9N3S and a molecular weight of 155.23 g/mol. Its IUPAC name is N-(thiadiazol-5-ylmethyl)cyclopropanamine.

Molecular Properties

Compound NameN-(thiadiazol-5-ylmethyl)cyclopropanamine
PubChem CID65214974
Molecular FormulaC6H9N3S
Molecular Weight155.23 g/mol
Exact Mass155.05
IUPAC NameN-(thiadiazol-5-ylmethyl)cyclopropanamine
SMILESc1nnsc1CNC1CC1
InChIInChI=1S/C6H9N3S/c1-2-5(1)7-3-6-4-8-9-10-6/h4-5,7H,1-3H2
InChIKeyZMAALDIVFVQDFY-UHFFFAOYSA-N
XLogP0.79
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.23
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(thiadiazol-5-ylmethyl)cyclopropanamine?
The IUPAC name of N-(thiadiazol-5-ylmethyl)cyclopropanamine (CID 65214974) is N-(thiadiazol-5-ylmethyl)cyclopropanamine.
What is the SMILES notation for N-(thiadiazol-5-ylmethyl)cyclopropanamine?
The canonical SMILES for N-(thiadiazol-5-ylmethyl)cyclopropanamine is c1nnsc1CNC1CC1.
What is the InChIKey of N-(thiadiazol-5-ylmethyl)cyclopropanamine?
The InChIKey is ZMAALDIVFVQDFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3S/c1-2-5(1)7-3-6-4-8-9-10-6/h4-5,7H,1-3H2.
What are the key properties of N-(thiadiazol-5-ylmethyl)cyclopropanamine?
N-(thiadiazol-5-ylmethyl)cyclopropanamine has a molecular weight of 155.23 g/mol, XLogP of 0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(thiadiazol-5-ylmethyl)cyclopropanamine is sourced from PubChem (CID 65214974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).