4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-methylthiadiazol-5-amine

C11H22N4OS — CID 62182823

IUPAC4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-methylthiadiazol-5-amine
SMILESCNc1snnc1CN(CCOC)CC(C)C
InChIInChI=1S/C11H22N4OS/c1-9(2)7-15(5-6-16-4)8-10-11(12-3)17-14-13-10/h9,12H,5-8H2,1-4H3
InChIKeyNGZICNPIRGSHPT-UHFFFAOYSA-N
MW258.39 g/mol
LogP1.68
Rot. Bonds8

About 4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-methylthiadiazol-5-amine

4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-methylthiadiazol-5-amine (PubChem CID 62182823) has the molecular formula C11H22N4OS and a molecular weight of 258.39 g/mol. Its IUPAC name is 4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-methylthiadiazol-5-amine.

Molecular Properties

Compound Name4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-methylthiadiazol-5-amine
PubChem CID62182823
Molecular FormulaC11H22N4OS
Molecular Weight258.39 g/mol
Exact Mass258.15
IUPAC Name4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-methylthiadiazol-5-amine
SMILESCNc1snnc1CN(CCOC)CC(C)C
InChIInChI=1S/C11H22N4OS/c1-9(2)7-15(5-6-16-4)8-10-11(12-3)17-14-13-10/h9,12H,5-8H2,1-4H3
InChIKeyNGZICNPIRGSHPT-UHFFFAOYSA-N
XLogP1.68
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.39
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-4-[[2-methylpropyl(pentan-3-yl)amino]methyl]thiadiazol-5-amine
CID 79491970
4-[[bis(2-methoxyethyl)amino]methyl]-N-propylthiadiazol-5-amine
CID 55046617
4-[[cyclopropyl(3-methylbutyl)amino]methyl]-N-methylthiadiazol-5-amine
CID 78986654
N-methyl-4-[[methyl(pentan-3-yl)amino]methyl]thiadiazol-5-amine
CID 62184537
N-methyl-4-[[methyl(propyl)amino]methyl]thiadiazol-5-amine
CID 62183083
4-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]thiadiazol-5-amine
CID 62209784
2-[butyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]acetamide
CID 62184428
2-[[2-methoxyethyl(2-methylpropyl)amino]methyl]pyridin-3-amine
CID 104739945
N-[[3-(2-aminopropan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-N-(2-methoxyethyl)-2-methylpropan-1-amine;hydrochloride
CID 119930437
4-[[ethyl(1-methoxypropan-2-yl)amino]methyl]-N-propylthiadiazol-5-amine
CID 62182120
4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-1,3-thiazole-2-carbohydrazide
CID 55214617
4-[[cyclohexyl(methyl)amino]methyl]-N-methylthiadiazol-5-amine
CID 62183035

Frequently Asked Questions

What is the IUPAC name of 4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-methylthiadiazol-5-amine?
The IUPAC name of 4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-methylthiadiazol-5-amine (CID 62182823) is 4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-methylthiadiazol-5-amine.
What is the SMILES notation for 4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-methylthiadiazol-5-amine?
The canonical SMILES for 4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-methylthiadiazol-5-amine is CNc1snnc1CN(CCOC)CC(C)C.
What is the InChIKey of 4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-methylthiadiazol-5-amine?
The InChIKey is NGZICNPIRGSHPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4OS/c1-9(2)7-15(5-6-16-4)8-10-11(12-3)17-14-13-10/h9,12H,5-8H2,1-4H3.
What are the key properties of 4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-methylthiadiazol-5-amine?
4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-methylthiadiazol-5-amine has a molecular weight of 258.39 g/mol, XLogP of 1.68, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-methylthiadiazol-5-amine is sourced from PubChem (CID 62182823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).