N-methyl-1-[1-(thiatriazol-5-yl)piperidin-3-yl]methanamine

C8H15N5S — CID 117045202

IUPACN-methyl-1-[1-(thiatriazol-5-yl)piperidin-3-yl]methanamine
SMILESCNCC1CCCN(c2nnns2)C1
InChIInChI=1S/C8H15N5S/c1-9-5-7-3-2-4-13(6-7)8-10-11-12-14-8/h7,9H,2-6H2,1H3
InChIKeyMBZJYQGEJOTILZ-UHFFFAOYSA-N
MW213.31 g/mol
LogP0.37
Rot. Bonds3

About N-methyl-1-[1-(thiatriazol-5-yl)piperidin-3-yl]methanamine

N-methyl-1-[1-(thiatriazol-5-yl)piperidin-3-yl]methanamine (PubChem CID 117045202) has the molecular formula C8H15N5S and a molecular weight of 213.31 g/mol. Its IUPAC name is N-methyl-1-[1-(thiatriazol-5-yl)piperidin-3-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[1-(thiatriazol-5-yl)piperidin-3-yl]methanamine
PubChem CID117045202
Molecular FormulaC8H15N5S
Molecular Weight213.31 g/mol
Exact Mass213.10
IUPAC NameN-methyl-1-[1-(thiatriazol-5-yl)piperidin-3-yl]methanamine
SMILESCNCC1CCCN(c2nnns2)C1
InChIInChI=1S/C8H15N5S/c1-9-5-7-3-2-4-13(6-7)8-10-11-12-14-8/h7,9H,2-6H2,1H3
InChIKeyMBZJYQGEJOTILZ-UHFFFAOYSA-N
XLogP0.37
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.31
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-methyl-1-[1-(thiatriazol-5-yl)piperidin-3-yl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[1-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]-N-methylmethanamine
CID 65276256
N-methyl-1-[1-(3-propyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]methanamine
CID 65276254
1-[1-(6-cyclobutylpyridazin-3-yl)piperidin-3-yl]-N-methylmethanamine
CID 116972459
N-methyl-1-[1-(1H-1,2,4-triazol-5-yl)piperidin-3-yl]methanamine
CID 102799744
N-methyl-1-[1-(5-methyl-2-pyridinyl)piperidin-3-yl]methanamine
CID 61204820
N-[[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]methyl]ethanamine
CID 65272861
N-methyl-1-[1-(4-methylpyrimidin-2-yl)piperidin-3-yl]methanamine
CID 62958741
1-[1-(5-fluoro-2-pyridinyl)piperidin-3-yl]-N-methylmethanamine
CID 61313343
5-bromo-4-[3-(methylaminomethyl)piperidin-1-yl]-1H-pyrimidin-6-one
CID 136977679
1-[1-[5-(methoxymethyl)-1H-1,2,4-triazol-3-yl]piperidin-3-yl]-N-methylmethanamine
CID 102799675
5-[3-(methylaminomethyl)piperidin-1-yl]pyridine-2-carbonitrile
CID 113321436
1-[4-ethyl-2-(3-ethylpiperidin-1-yl)-1,3-thiazol-5-yl]-N-methylmethanamine
CID 55117606

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-(thiatriazol-5-yl)piperidin-3-yl]methanamine?
The IUPAC name of N-methyl-1-[1-(thiatriazol-5-yl)piperidin-3-yl]methanamine (CID 117045202) is N-methyl-1-[1-(thiatriazol-5-yl)piperidin-3-yl]methanamine.
What is the SMILES notation for N-methyl-1-[1-(thiatriazol-5-yl)piperidin-3-yl]methanamine?
The canonical SMILES for N-methyl-1-[1-(thiatriazol-5-yl)piperidin-3-yl]methanamine is CNCC1CCCN(c2nnns2)C1.
What is the InChIKey of N-methyl-1-[1-(thiatriazol-5-yl)piperidin-3-yl]methanamine?
The InChIKey is MBZJYQGEJOTILZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N5S/c1-9-5-7-3-2-4-13(6-7)8-10-11-12-14-8/h7,9H,2-6H2,1H3.
What are the key properties of N-methyl-1-[1-(thiatriazol-5-yl)piperidin-3-yl]methanamine?
N-methyl-1-[1-(thiatriazol-5-yl)piperidin-3-yl]methanamine has a molecular weight of 213.31 g/mol, XLogP of 0.37, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-(thiatriazol-5-yl)piperidin-3-yl]methanamine is sourced from PubChem (CID 117045202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).