3-(methoxymethyl)-N-(1-methylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine

C10H18N4OS — CID 133383314

IUPAC3-(methoxymethyl)-N-(1-methylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine
SMILESCOCc1nsc(NC2CCN(C)CC2)n1
InChIInChI=1S/C10H18N4OS/c1-14-5-3-8(4-6-14)11-10-12-9(7-15-2)13-16-10/h8H,3-7H2,1-2H3,(H,11,12,13)
InChIKeyRQDLAPLWEMNGMZ-UHFFFAOYSA-N
MW242.35 g/mol
LogP1.19
Rot. Bonds4

About 3-(methoxymethyl)-N-(1-methylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine

3-(methoxymethyl)-N-(1-methylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine (PubChem CID 133383314) has the molecular formula C10H18N4OS and a molecular weight of 242.35 g/mol. Its IUPAC name is 3-(methoxymethyl)-N-(1-methylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound Name3-(methoxymethyl)-N-(1-methylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine
PubChem CID133383314
Molecular FormulaC10H18N4OS
Molecular Weight242.35 g/mol
Exact Mass242.12
IUPAC Name3-(methoxymethyl)-N-(1-methylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine
SMILESCOCc1nsc(NC2CCN(C)CC2)n1
InChIInChI=1S/C10H18N4OS/c1-14-5-3-8(4-6-14)11-10-12-9(7-15-2)13-16-10/h8H,3-7H2,1-2H3,(H,11,12,13)
InChIKeyRQDLAPLWEMNGMZ-UHFFFAOYSA-N
XLogP1.19
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.35
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-3-(methoxymethyl)-1,2,4-thiadiazol-5-amine
CID 133336157
3-(methoxymethyl)-5-(4-methylpiperazin-1-yl)-1,2,4-thiadiazole
CID 175647986
N-cyclopropyl-3-[(dimethylamino)methyl]-1,2,4-thiadiazol-5-amine
CID 79085318
(1S,2R)-1-[[3-(methoxymethyl)-1,2,4-thiadiazol-5-yl]amino]-2,3-dihydro-1H-inden-2-ol
CID 133448027
4-ethyl-N-(1-methylpiperidin-4-yl)-1,3-thiazol-2-amine
CID 62961905
N-(1,3-dimethylpiperidin-4-yl)-3-ethyl-1,2,4-thiadiazol-5-amine
CID 115886007
3-methyl-N-(1-propylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine
CID 65267689
3-cyclopropyl-N-(1-methylpyrrolidin-3-yl)-1,2,4-thiadiazol-5-amine
CID 65276548
2-[4-[[3-(methoxymethyl)-1,2,4-thiadiazol-5-yl]amino]cyclohexyl]-6-pyridin-3-ylpyridazin-3-one
CID 126936441
N-[1-[3-(methoxymethyl)-1,2,4-thiadiazol-5-yl]piperidin-4-yl]pyrimidin-4-amine
CID 126887417
methyl 2-[2-[(1-methylpiperidin-4-yl)amino]-1,3-thiazol-4-yl]acetate
CID 80574702
cyclopentyl-[3-[[3-(2-methoxyethyl)-1,2,4-thiadiazol-5-yl]amino]pyrrolidin-1-yl]methanone
CID 133366768

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-N-(1-methylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine?
The IUPAC name of 3-(methoxymethyl)-N-(1-methylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine (CID 133383314) is 3-(methoxymethyl)-N-(1-methylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for 3-(methoxymethyl)-N-(1-methylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine?
The canonical SMILES for 3-(methoxymethyl)-N-(1-methylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine is COCc1nsc(NC2CCN(C)CC2)n1.
What is the InChIKey of 3-(methoxymethyl)-N-(1-methylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine?
The InChIKey is RQDLAPLWEMNGMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4OS/c1-14-5-3-8(4-6-14)11-10-12-9(7-15-2)13-16-10/h8H,3-7H2,1-2H3,(H,11,12,13).
What are the key properties of 3-(methoxymethyl)-N-(1-methylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine?
3-(methoxymethyl)-N-(1-methylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine has a molecular weight of 242.35 g/mol, XLogP of 1.19, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-N-(1-methylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 133383314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).