N-[(1,4-dimethylpiperidin-4-yl)methyl]-1,2,4-thiadiazol-5-amine

C10H18N4S — CID 107164406

IUPACN-[(1,4-dimethylpiperidin-4-yl)methyl]-1,2,4-thiadiazol-5-amine
SMILESCN1CCC(C)(CNc2ncns2)CC1
InChIInChI=1S/C10H18N4S/c1-10(3-5-14(2)6-4-10)7-11-9-12-8-13-15-9/h8H,3-7H2,1-2H3,(H,11,12,13)
InChIKeyGHIFPCOIFRUQBR-UHFFFAOYSA-N
MW226.35 g/mol
LogP1.68
Rot. Bonds3

About N-[(1,4-dimethylpiperidin-4-yl)methyl]-1,2,4-thiadiazol-5-amine

N-[(1,4-dimethylpiperidin-4-yl)methyl]-1,2,4-thiadiazol-5-amine (PubChem CID 107164406) has the molecular formula C10H18N4S and a molecular weight of 226.35 g/mol. Its IUPAC name is N-[(1,4-dimethylpiperidin-4-yl)methyl]-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound NameN-[(1,4-dimethylpiperidin-4-yl)methyl]-1,2,4-thiadiazol-5-amine
PubChem CID107164406
Molecular FormulaC10H18N4S
Molecular Weight226.35 g/mol
Exact Mass226.13
IUPAC NameN-[(1,4-dimethylpiperidin-4-yl)methyl]-1,2,4-thiadiazol-5-amine
SMILESCN1CCC(C)(CNc2ncns2)CC1
InChIInChI=1S/C10H18N4S/c1-10(3-5-14(2)6-4-10)7-11-9-12-8-13-15-9/h8H,3-7H2,1-2H3,(H,11,12,13)
InChIKeyGHIFPCOIFRUQBR-UHFFFAOYSA-N
XLogP1.68
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.35
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[1-(dimethylamino)cyclopentyl]methyl]-1,2,4-thiadiazol-5-amine
CID 82712959
6-bromo-N-[(1,4-dimethylpiperidin-4-yl)methyl]pyrimidin-4-amine
CID 107164897
N-[(1,4-dimethylpiperidin-4-yl)methyl]-1,3-benzothiazol-2-amine
CID 103989880
1-[(1,2,4-thiadiazol-5-ylamino)methyl]cyclohexan-1-ol
CID 65274526
5-chloro-N-[(1,4-dimethylpiperidin-4-yl)methyl]pyrimidin-4-amine
CID 102975963
N-[(1,4-dimethylpiperidin-4-yl)methyl]-4,6-dimethylpyrimidin-2-amine
CID 103989884
5-N-[(1,4-dimethylpiperidin-4-yl)methyl]-4-methyl-1,2-thiazole-3,5-diamine
CID 107165740
N-[(1,4-dimethylpiperidin-4-yl)methyl]-6-propylpyrimidin-4-amine
CID 107164291
N-[[1-(aminomethyl)cyclohexyl]methyl]-1,2,4-thiadiazol-5-amine
CID 103970418
4-N-[(1,4-dimethylpiperidin-4-yl)methyl]-6-propoxypyrimidine-4,5-diamine
CID 107163063
4-chloro-2-[(1,4-dimethylpiperidin-4-yl)methylamino]-1,3-thiazole-5-carbonitrile
CID 107164353
N-[(1,4-dimethylpiperidin-4-yl)methyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 107164463

Frequently Asked Questions

What is the IUPAC name of N-[(1,4-dimethylpiperidin-4-yl)methyl]-1,2,4-thiadiazol-5-amine?
The IUPAC name of N-[(1,4-dimethylpiperidin-4-yl)methyl]-1,2,4-thiadiazol-5-amine (CID 107164406) is N-[(1,4-dimethylpiperidin-4-yl)methyl]-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for N-[(1,4-dimethylpiperidin-4-yl)methyl]-1,2,4-thiadiazol-5-amine?
The canonical SMILES for N-[(1,4-dimethylpiperidin-4-yl)methyl]-1,2,4-thiadiazol-5-amine is CN1CCC(C)(CNc2ncns2)CC1.
What is the InChIKey of N-[(1,4-dimethylpiperidin-4-yl)methyl]-1,2,4-thiadiazol-5-amine?
The InChIKey is GHIFPCOIFRUQBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4S/c1-10(3-5-14(2)6-4-10)7-11-9-12-8-13-15-9/h8H,3-7H2,1-2H3,(H,11,12,13).
What are the key properties of N-[(1,4-dimethylpiperidin-4-yl)methyl]-1,2,4-thiadiazol-5-amine?
N-[(1,4-dimethylpiperidin-4-yl)methyl]-1,2,4-thiadiazol-5-amine has a molecular weight of 226.35 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,4-dimethylpiperidin-4-yl)methyl]-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 107164406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).