N-methyl-1-(1,2,4-thiadiazol-5-yl)propan-2-amine

C6H11N3S — CID 65280243

IUPACN-methyl-1-(1,2,4-thiadiazol-5-yl)propan-2-amine
SMILESCNC(C)Cc1ncns1
InChIInChI=1S/C6H11N3S/c1-5(7-2)3-6-8-4-9-10-6/h4-5,7H,3H2,1-2H3
InChIKeySXNOUAIHMKXJOS-UHFFFAOYSA-N
MW157.24 g/mol
LogP0.69
Rot. Bonds3

About N-methyl-1-(1,2,4-thiadiazol-5-yl)propan-2-amine

N-methyl-1-(1,2,4-thiadiazol-5-yl)propan-2-amine (PubChem CID 65280243) has the molecular formula C6H11N3S and a molecular weight of 157.24 g/mol. Its IUPAC name is N-methyl-1-(1,2,4-thiadiazol-5-yl)propan-2-amine.

Molecular Properties

Compound NameN-methyl-1-(1,2,4-thiadiazol-5-yl)propan-2-amine
PubChem CID65280243
Molecular FormulaC6H11N3S
Molecular Weight157.24 g/mol
Exact Mass157.07
IUPAC NameN-methyl-1-(1,2,4-thiadiazol-5-yl)propan-2-amine
SMILESCNC(C)Cc1ncns1
InChIInChI=1S/C6H11N3S/c1-5(7-2)3-6-8-4-9-10-6/h4-5,7H,3H2,1-2H3
InChIKeySXNOUAIHMKXJOS-UHFFFAOYSA-N
XLogP0.69
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.24
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1,1,1-Trifluoro-3-(1,2,4-thiadiazol-5-yl)propan-2-amine
CID 82399164
2-Fluoro-2-(1,2,4-thiadiazol-5-yl)propan-1-amine
CID 84021211
5-Pyrrolidin-2-yl-1,2,4-thiadiazole
CID 19934504
1-(1,2,4-Thiadiazol-5-yl)propan-2-imine
CID 54474176
5-Propyl-1,2,4-thiadiazole
CID 57105303
5-[(2S)-pyrrolidin-2-yl]-1,2,4-thiadiazole
CID 68841070
N-(1,2,4-thiadiazol-5-ylmethyl)propan-2-amine
CID 82415856
5-Pyrrolidin-3-yl-1,2,4-thiadiazole
CID 82595706
1-(5-deuterio-1,2,4-thiadiazol-3-yl)-N-methylpropan-2-amine
CID 175850298
1-(3-Methyl-1,2,4-thiadiazol-5-yl)propan-2-amine
CID 65272740
N-methyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)butan-2-amine
CID 65272986
N-methyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)propan-2-amine
CID 65273224

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1,2,4-thiadiazol-5-yl)propan-2-amine?
The IUPAC name of N-methyl-1-(1,2,4-thiadiazol-5-yl)propan-2-amine (CID 65280243) is N-methyl-1-(1,2,4-thiadiazol-5-yl)propan-2-amine.
What is the SMILES notation for N-methyl-1-(1,2,4-thiadiazol-5-yl)propan-2-amine?
The canonical SMILES for N-methyl-1-(1,2,4-thiadiazol-5-yl)propan-2-amine is CNC(C)Cc1ncns1.
What is the InChIKey of N-methyl-1-(1,2,4-thiadiazol-5-yl)propan-2-amine?
The InChIKey is SXNOUAIHMKXJOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3S/c1-5(7-2)3-6-8-4-9-10-6/h4-5,7H,3H2,1-2H3.
What are the key properties of N-methyl-1-(1,2,4-thiadiazol-5-yl)propan-2-amine?
N-methyl-1-(1,2,4-thiadiazol-5-yl)propan-2-amine has a molecular weight of 157.24 g/mol, XLogP of 0.69, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1,2,4-thiadiazol-5-yl)propan-2-amine is sourced from PubChem (CID 65280243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).