N-ethyl-2-[methyl-[[5-(propylamino)thiadiazol-4-yl]methyl]amino]acetamide

C11H21N5OS — CID 62209620

IUPACN-ethyl-2-[methyl-[[5-(propylamino)thiadiazol-4-yl]methyl]amino]acetamide
SMILESCCCNc1snnc1CN(C)CC(=O)NCC
InChIInChI=1S/C11H21N5OS/c1-4-6-13-11-9(14-15-18-11)7-16(3)8-10(17)12-5-2/h13H,4-8H2,1-3H3,(H,12,17)
InChIKeyMYEBYEOZHVEVHZ-UHFFFAOYSA-N
MW271.39 g/mol
LogP0.93
Rot. Bonds8

About N-ethyl-2-[methyl-[[5-(propylamino)thiadiazol-4-yl]methyl]amino]acetamide

N-ethyl-2-[methyl-[[5-(propylamino)thiadiazol-4-yl]methyl]amino]acetamide (PubChem CID 62209620) has the molecular formula C11H21N5OS and a molecular weight of 271.39 g/mol. Its IUPAC name is N-ethyl-2-[methyl-[[5-(propylamino)thiadiazol-4-yl]methyl]amino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[methyl-[[5-(propylamino)thiadiazol-4-yl]methyl]amino]acetamide
PubChem CID62209620
Molecular FormulaC11H21N5OS
Molecular Weight271.39 g/mol
Exact Mass271.15
IUPAC NameN-ethyl-2-[methyl-[[5-(propylamino)thiadiazol-4-yl]methyl]amino]acetamide
SMILESCCCNc1snnc1CN(C)CC(=O)NCC
InChIInChI=1S/C11H21N5OS/c1-4-6-13-11-9(14-15-18-11)7-16(3)8-10(17)12-5-2/h13H,4-8H2,1-3H3,(H,12,17)
InChIKeyMYEBYEOZHVEVHZ-UHFFFAOYSA-N
XLogP0.93
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.39
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-2-[methyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]acetamide
CID 62183804
4-[[methyl(2-methylbutan-2-yl)amino]methyl]-N-propylthiadiazol-5-amine
CID 63966703
2-methyl-3-[methyl-[[5-(propylamino)thiadiazol-4-yl]methyl]amino]propanenitrile
CID 62183362
4-[[(4-bromothiophen-2-yl)methyl-methylamino]methyl]-N-propylthiadiazol-5-amine
CID 62183351
4-[[methyl-[(2-methylphenyl)methyl]amino]methyl]-N-propylthiadiazol-5-amine
CID 62208773
4-[[methyl-[[5-(propylamino)thiadiazol-4-yl]methyl]amino]methyl]oxan-4-ol
CID 114953247
4-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-N-propylthiadiazol-5-amine
CID 62181934
2-[[5-(ethylamino)thiadiazol-4-yl]methyl-propylamino]-N-methylacetamide
CID 62208248
N-propyl-4-[(N,2,4-trimethylanilino)methyl]thiadiazol-5-amine
CID 62207883
4-[[(2-fluorophenyl)methyl-methylamino]methyl]-N-propylthiadiazol-5-amine
CID 62208073
1-[[5-(ethylamino)thiadiazol-4-yl]methyl-methylamino]propan-2-ol
CID 62337157
2-[cyanomethyl-[[5-(propylamino)thiadiazol-4-yl]methyl]amino]acetonitrile
CID 55046735

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[methyl-[[5-(propylamino)thiadiazol-4-yl]methyl]amino]acetamide?
The IUPAC name of N-ethyl-2-[methyl-[[5-(propylamino)thiadiazol-4-yl]methyl]amino]acetamide (CID 62209620) is N-ethyl-2-[methyl-[[5-(propylamino)thiadiazol-4-yl]methyl]amino]acetamide.
What is the SMILES notation for N-ethyl-2-[methyl-[[5-(propylamino)thiadiazol-4-yl]methyl]amino]acetamide?
The canonical SMILES for N-ethyl-2-[methyl-[[5-(propylamino)thiadiazol-4-yl]methyl]amino]acetamide is CCCNc1snnc1CN(C)CC(=O)NCC.
What is the InChIKey of N-ethyl-2-[methyl-[[5-(propylamino)thiadiazol-4-yl]methyl]amino]acetamide?
The InChIKey is MYEBYEOZHVEVHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5OS/c1-4-6-13-11-9(14-15-18-11)7-16(3)8-10(17)12-5-2/h13H,4-8H2,1-3H3,(H,12,17).
What are the key properties of N-ethyl-2-[methyl-[[5-(propylamino)thiadiazol-4-yl]methyl]amino]acetamide?
N-ethyl-2-[methyl-[[5-(propylamino)thiadiazol-4-yl]methyl]amino]acetamide has a molecular weight of 271.39 g/mol, XLogP of 0.93, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[methyl-[[5-(propylamino)thiadiazol-4-yl]methyl]amino]acetamide is sourced from PubChem (CID 62209620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).