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

C8H14N4S — CID 114695446

IUPACN-(2-methylpiperidin-3-yl)-1,3,4-thiadiazol-2-amine
SMILESCC1NCCCC1Nc1nncs1
InChIInChI=1S/C8H14N4S/c1-6-7(3-2-4-9-6)11-8-12-10-5-13-8/h5-7,9H,2-4H2,1H3,(H,11,12)
InChIKeyMKUMZBFUVRXABD-UHFFFAOYSA-N
MW198.29 g/mol
LogP1.09
Rot. Bonds2

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

N-(2-methylpiperidin-3-yl)-1,3,4-thiadiazol-2-amine (PubChem CID 114695446) has the molecular formula C8H14N4S and a molecular weight of 198.29 g/mol. Its IUPAC name is N-(2-methylpiperidin-3-yl)-1,3,4-thiadiazol-2-amine.

Molecular Properties

Compound NameN-(2-methylpiperidin-3-yl)-1,3,4-thiadiazol-2-amine
PubChem CID114695446
Molecular FormulaC8H14N4S
Molecular Weight198.29 g/mol
Exact Mass198.09
IUPAC NameN-(2-methylpiperidin-3-yl)-1,3,4-thiadiazol-2-amine
SMILESCC1NCCCC1Nc1nncs1
InChIInChI=1S/C8H14N4S/c1-6-7(3-2-4-9-6)11-8-12-10-5-13-8/h5-7,9H,2-4H2,1H3,(H,11,12)
InChIKeyMKUMZBFUVRXABD-UHFFFAOYSA-N
XLogP1.09
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

N-(2-methylthian-3-yl)-1,3,4-thiadiazol-2-amine
CID 107648654
4-chloro-N-[(2S,3S)-2-methylpiperidin-3-yl]-1,3-thiazol-2-amine
CID 130908656
N-(2,6-dimethylcyclohexyl)-1,3,4-thiadiazol-2-amine
CID 107648553
N-(2-methylpiperidin-3-yl)thieno[3,2-c]pyridin-4-amine
CID 114695478
2-methyl-N-(3-methyltriazol-4-yl)piperidin-3-amine
CID 130486758
3,6-dichloro-N-(2-methylpiperidin-3-yl)pyridazin-4-amine
CID 114695592
5-iodo-N-(2-methylpiperidin-3-yl)pyrimidin-2-amine
CID 114695529
2-[(2S)-pyrrolidin-2-yl]-1,3,4-thiadiazole;hydrochloride
CID 127256245
6-methoxy-5-methyl-N-(2-methylpiperidin-3-yl)pyrimidin-4-amine
CID 114695492
3-bromo-N-(2-methylpiperidin-3-yl)pyridin-4-amine
CID 114695454
N-spiro[4.5]decan-8-yl-1,3,4-thiadiazol-2-amine
CID 107648892
N-(2-methylpiperidin-3-yl)-5,6,7,8-tetrahydroquinazolin-4-amine
CID 114695362

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpiperidin-3-yl)-1,3,4-thiadiazol-2-amine?
The IUPAC name of N-(2-methylpiperidin-3-yl)-1,3,4-thiadiazol-2-amine (CID 114695446) is N-(2-methylpiperidin-3-yl)-1,3,4-thiadiazol-2-amine.
What is the SMILES notation for N-(2-methylpiperidin-3-yl)-1,3,4-thiadiazol-2-amine?
The canonical SMILES for N-(2-methylpiperidin-3-yl)-1,3,4-thiadiazol-2-amine is CC1NCCCC1Nc1nncs1.
What is the InChIKey of N-(2-methylpiperidin-3-yl)-1,3,4-thiadiazol-2-amine?
The InChIKey is MKUMZBFUVRXABD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4S/c1-6-7(3-2-4-9-6)11-8-12-10-5-13-8/h5-7,9H,2-4H2,1H3,(H,11,12).
What are the key properties of N-(2-methylpiperidin-3-yl)-1,3,4-thiadiazol-2-amine?
N-(2-methylpiperidin-3-yl)-1,3,4-thiadiazol-2-amine has a molecular weight of 198.29 g/mol, XLogP of 1.09, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpiperidin-3-yl)-1,3,4-thiadiazol-2-amine is sourced from PubChem (CID 114695446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).