2-methyl-N-(thiadiazol-5-ylmethyl)propan-2-amine

C7H13N3S — CID 65214975

IUPAC2-methyl-N-(thiadiazol-5-ylmethyl)propan-2-amine
SMILESCC(C)(C)NCc1cnns1
InChIInChI=1S/C7H13N3S/c1-7(2,3)8-4-6-5-9-10-11-6/h5,8H,4H2,1-3H3
InChIKeyFRWAKCPEEKUPML-UHFFFAOYSA-N
MW171.27 g/mol
LogP1.43
Rot. Bonds2

About 2-methyl-N-(thiadiazol-5-ylmethyl)propan-2-amine

2-methyl-N-(thiadiazol-5-ylmethyl)propan-2-amine (PubChem CID 65214975) has the molecular formula C7H13N3S and a molecular weight of 171.27 g/mol. Its IUPAC name is 2-methyl-N-(thiadiazol-5-ylmethyl)propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-(thiadiazol-5-ylmethyl)propan-2-amine
PubChem CID65214975
Molecular FormulaC7H13N3S
Molecular Weight171.27 g/mol
Exact Mass171.08
IUPAC Name2-methyl-N-(thiadiazol-5-ylmethyl)propan-2-amine
SMILESCC(C)(C)NCc1cnns1
InChIInChI=1S/C7H13N3S/c1-7(2,3)8-4-6-5-9-10-11-6/h5,8H,4H2,1-3H3
InChIKeyFRWAKCPEEKUPML-UHFFFAOYSA-N
XLogP1.43
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.27
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methyl-N-(thiadiazol-5-ylmethyl)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

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(thiadiazol-5-ylmethyl)propan-2-amine?
The IUPAC name of 2-methyl-N-(thiadiazol-5-ylmethyl)propan-2-amine (CID 65214975) is 2-methyl-N-(thiadiazol-5-ylmethyl)propan-2-amine.
What is the SMILES notation for 2-methyl-N-(thiadiazol-5-ylmethyl)propan-2-amine?
The canonical SMILES for 2-methyl-N-(thiadiazol-5-ylmethyl)propan-2-amine is CC(C)(C)NCc1cnns1.
What is the InChIKey of 2-methyl-N-(thiadiazol-5-ylmethyl)propan-2-amine?
The InChIKey is FRWAKCPEEKUPML-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3S/c1-7(2,3)8-4-6-5-9-10-11-6/h5,8H,4H2,1-3H3.
What are the key properties of 2-methyl-N-(thiadiazol-5-ylmethyl)propan-2-amine?
2-methyl-N-(thiadiazol-5-ylmethyl)propan-2-amine has a molecular weight of 171.27 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(thiadiazol-5-ylmethyl)propan-2-amine is sourced from PubChem (CID 65214975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).