2-[ethyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]-N,N-dimethylacetamide

C10H19N5OS — CID 55046374

IUPAC2-[ethyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]-N,N-dimethylacetamide
SMILESCCN(CC(=O)N(C)C)Cc1nnsc1NC
InChIInChI=1S/C10H19N5OS/c1-5-15(7-9(16)14(3)4)6-8-10(11-2)17-13-12-8/h11H,5-7H2,1-4H3
InChIKeyMVUNDIOKUYPEFS-UHFFFAOYSA-N
MW257.36 g/mol
LogP0.49
Rot. Bonds6

About 2-[ethyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]-N,N-dimethylacetamide

2-[ethyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]-N,N-dimethylacetamide (PubChem CID 55046374) has the molecular formula C10H19N5OS and a molecular weight of 257.36 g/mol. Its IUPAC name is 2-[ethyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[ethyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]-N,N-dimethylacetamide
PubChem CID55046374
Molecular FormulaC10H19N5OS
Molecular Weight257.36 g/mol
Exact Mass257.13
IUPAC Name2-[ethyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]-N,N-dimethylacetamide
SMILESCCN(CC(=O)N(C)C)Cc1nnsc1NC
InChIInChI=1S/C10H19N5OS/c1-5-15(7-9(16)14(3)4)6-8-10(11-2)17-13-12-8/h11H,5-7H2,1-4H3
InChIKeyMVUNDIOKUYPEFS-UHFFFAOYSA-N
XLogP0.49
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.36
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]-N,N-dimethylacetamide?
The IUPAC name of 2-[ethyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]-N,N-dimethylacetamide (CID 55046374) is 2-[ethyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[ethyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[ethyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]-N,N-dimethylacetamide is CCN(CC(=O)N(C)C)Cc1nnsc1NC.
What is the InChIKey of 2-[ethyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]-N,N-dimethylacetamide?
The InChIKey is MVUNDIOKUYPEFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5OS/c1-5-15(7-9(16)14(3)4)6-8-10(11-2)17-13-12-8/h11H,5-7H2,1-4H3.
What are the key properties of 2-[ethyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]-N,N-dimethylacetamide?
2-[ethyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]-N,N-dimethylacetamide has a molecular weight of 257.36 g/mol, XLogP of 0.49, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]-N,N-dimethylacetamide is sourced from PubChem (CID 55046374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).