4-methyl-5-(pyridin-2-ylmethyl)-1,3,4-thiadiazolidin-2-amine

C9H14N4S — CID 144665164

IUPAC4-methyl-5-(pyridin-2-ylmethyl)-1,3,4-thiadiazolidin-2-amine
SMILESCN1NC(N)SC1Cc1ccccn1
InChIInChI=1S/C9H14N4S/c1-13-8(14-9(10)12-13)6-7-4-2-3-5-11-7/h2-5,8-9,12H,6,10H2,1H3
InChIKeyVUIHBAFCUAYKLK-UHFFFAOYSA-N
MW210.31 g/mol
LogP0.38
Rot. Bonds2

About 4-methyl-5-(pyridin-2-ylmethyl)-1,3,4-thiadiazolidin-2-amine

4-methyl-5-(pyridin-2-ylmethyl)-1,3,4-thiadiazolidin-2-amine (PubChem CID 144665164) has the molecular formula C9H14N4S and a molecular weight of 210.31 g/mol. Its IUPAC name is 4-methyl-5-(pyridin-2-ylmethyl)-1,3,4-thiadiazolidin-2-amine.

Molecular Properties

Compound Name4-methyl-5-(pyridin-2-ylmethyl)-1,3,4-thiadiazolidin-2-amine
PubChem CID144665164
Molecular FormulaC9H14N4S
Molecular Weight210.31 g/mol
Exact Mass210.09
IUPAC Name4-methyl-5-(pyridin-2-ylmethyl)-1,3,4-thiadiazolidin-2-amine
SMILESCN1NC(N)SC1Cc1ccccn1
InChIInChI=1S/C9H14N4S/c1-13-8(14-9(10)12-13)6-7-4-2-3-5-11-7/h2-5,8-9,12H,6,10H2,1H3
InChIKeyVUIHBAFCUAYKLK-UHFFFAOYSA-N
XLogP0.38
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.31
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-methyl-5-(pyridin-2-ylmethyl)-1,3,4-thiadiazolidin-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

cis-(1R,2S)-2-(pyridin-2-ylmethyl)cyclopentan-1-amine
CID 96630031
ethane;pyridin-2-ylmethanamine
CID 90791011
(3R,4R)-2-methyl-1,1-dioxo-3-(pyridin-2-ylmethyl)-3,4-dihydro-1λ6,2-benzothiazin-4-ol
CID 51690821
5-methyl-3-(2-pyridin-2-ylethyl)-1,3-thiazinan-2-amine
CID 175881809
4-methyl-1-(2-pyridin-2-ylethyl)pyrrolidin-3-amine
CID 103576660
3-methyl-4-(pyridin-2-ylmethyl)-1,3-oxazolidin-2-one
CID 19987344
2-[(1,2-dimethylpiperidin-4-yl)methyl]pyridine
CID 174968091
2-ethylpyridine;sulfane
CID 67363352
ethane;2-ethylpyridine
CID 91102000
N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
CID 174963433
ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine
CID 145471467
2-(cyclohexylmethyl)pyridine
CID 14762660

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-(pyridin-2-ylmethyl)-1,3,4-thiadiazolidin-2-amine?
The IUPAC name of 4-methyl-5-(pyridin-2-ylmethyl)-1,3,4-thiadiazolidin-2-amine (CID 144665164) is 4-methyl-5-(pyridin-2-ylmethyl)-1,3,4-thiadiazolidin-2-amine.
What is the SMILES notation for 4-methyl-5-(pyridin-2-ylmethyl)-1,3,4-thiadiazolidin-2-amine?
The canonical SMILES for 4-methyl-5-(pyridin-2-ylmethyl)-1,3,4-thiadiazolidin-2-amine is CN1NC(N)SC1Cc1ccccn1.
What is the InChIKey of 4-methyl-5-(pyridin-2-ylmethyl)-1,3,4-thiadiazolidin-2-amine?
The InChIKey is VUIHBAFCUAYKLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4S/c1-13-8(14-9(10)12-13)6-7-4-2-3-5-11-7/h2-5,8-9,12H,6,10H2,1H3.
What are the key properties of 4-methyl-5-(pyridin-2-ylmethyl)-1,3,4-thiadiazolidin-2-amine?
4-methyl-5-(pyridin-2-ylmethyl)-1,3,4-thiadiazolidin-2-amine has a molecular weight of 210.31 g/mol, XLogP of 0.38, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-(pyridin-2-ylmethyl)-1,3,4-thiadiazolidin-2-amine is sourced from PubChem (CID 144665164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).