1-(4-methylthiadiazol-5-yl)propan-2-amine

C6H11N3S — CID 130600407

IUPAC1-(4-methylthiadiazol-5-yl)propan-2-amine
SMILESCc1nnsc1CC(C)N
InChIInChI=1S/C6H11N3S/c1-4(7)3-6-5(2)8-9-10-6/h4H,3,7H2,1-2H3
InChIKeyWTYKUFXQNVMPPO-UHFFFAOYSA-N
MW157.24 g/mol
LogP0.74
Rot. Bonds2

About 1-(4-methylthiadiazol-5-yl)propan-2-amine

1-(4-methylthiadiazol-5-yl)propan-2-amine (PubChem CID 130600407) has the molecular formula C6H11N3S and a molecular weight of 157.24 g/mol. Its IUPAC name is 1-(4-methylthiadiazol-5-yl)propan-2-amine.

Molecular Properties

Compound Name1-(4-methylthiadiazol-5-yl)propan-2-amine
PubChem CID130600407
Molecular FormulaC6H11N3S
Molecular Weight157.24 g/mol
Exact Mass157.07
IUPAC Name1-(4-methylthiadiazol-5-yl)propan-2-amine
SMILESCc1nnsc1CC(C)N
InChIInChI=1S/C6H11N3S/c1-4(7)3-6-5(2)8-9-10-6/h4H,3,7H2,1-2H3
InChIKeyWTYKUFXQNVMPPO-UHFFFAOYSA-N
XLogP0.74
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.24
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(4-methylthiadiazol-5-yl)propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-Methyl-5-propylthiadiazole
CID 12913685
1-(4-Ethylthiadiazol-5-yl)-4,4,4-trifluorobutan-1-amine
CID 105156248
4,4,4-Trifluoro-1-(4-methylthiadiazol-5-yl)butan-1-amine
CID 105156486
4,4,4-Trifluoro-1-(4-propylthiadiazol-5-yl)butan-1-amine
CID 105156493
1-(4-Ethylthiadiazol-5-yl)-5,5,5-trifluoropentan-1-amine
CID 105174232
5,5,5-Trifluoro-1-(4-methylthiadiazol-5-yl)pentan-1-amine
CID 105174469
(1R)-3,3,3-trifluoro-1-(4-methylthiadiazol-5-yl)propan-1-amine
CID 130863581
(1S)-3,3,3-trifluoro-1-(4-methylthiadiazol-5-yl)propan-1-amine
CID 131142288
4-Methyl-5-pentyl-1,2,3-thiadiazole
CID 13427196
2-Methyl-1-(4-methylthiadiazol-5-yl)propan-2-amine
CID 23111159
5-Butyl-4-methylthiadiazole
CID 23383489
5-Methyl-4-propylthiadiazole
CID 119097950

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylthiadiazol-5-yl)propan-2-amine?
The IUPAC name of 1-(4-methylthiadiazol-5-yl)propan-2-amine (CID 130600407) is 1-(4-methylthiadiazol-5-yl)propan-2-amine.
What is the SMILES notation for 1-(4-methylthiadiazol-5-yl)propan-2-amine?
The canonical SMILES for 1-(4-methylthiadiazol-5-yl)propan-2-amine is Cc1nnsc1CC(C)N.
What is the InChIKey of 1-(4-methylthiadiazol-5-yl)propan-2-amine?
The InChIKey is WTYKUFXQNVMPPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3S/c1-4(7)3-6-5(2)8-9-10-6/h4H,3,7H2,1-2H3.
What are the key properties of 1-(4-methylthiadiazol-5-yl)propan-2-amine?
1-(4-methylthiadiazol-5-yl)propan-2-amine has a molecular weight of 157.24 g/mol, XLogP of 0.74, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylthiadiazol-5-yl)propan-2-amine is sourced from PubChem (CID 130600407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).