4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-2-imine

C10H13N3S — CID 135934658

IUPAC4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-2-imine
SMILESCC1CS/C(=N/Cc2cccnc2)N1
InChIInChI=1S/C10H13N3S/c1-8-7-14-10(13-8)12-6-9-3-2-4-11-5-9/h2-5,8H,6-7H2,1H3,(H,12,13)
InChIKeyCVVJCANNHXUZLN-UHFFFAOYSA-N
MW207.30 g/mol
LogP1.66
Rot. Bonds2

About 4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-2-imine

4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-2-imine (PubChem CID 135934658) has the molecular formula C10H13N3S and a molecular weight of 207.30 g/mol. Its IUPAC name is 4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-2-imine.

Molecular Properties

Compound Name4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-2-imine
PubChem CID135934658
Molecular FormulaC10H13N3S
Molecular Weight207.30 g/mol
Exact Mass207.08
IUPAC Name4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-2-imine
SMILESCC1CS/C(=N/Cc2cccnc2)N1
InChIInChI=1S/C10H13N3S/c1-8-7-14-10(13-8)12-6-9-3-2-4-11-5-9/h2-5,8H,6-7H2,1H3,(H,12,13)
InChIKeyCVVJCANNHXUZLN-UHFFFAOYSA-N
XLogP1.66
TPSA37.28 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.30
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-2-imine 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

4-ethyl-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-2-imine
CID 135934660
N-(pyridin-3-ylmethyl)-1,4,4a,5,6,7,8,8a-octahydrobenzo[d][1,3]thiazin-2-imine
CID 136746919
4-benzyl-N-[(4-methyl-3-pyridinyl)methyl]-1,3-thiazolidin-2-imine
CID 136981181
3-[[(4,5-dimethyl-1,3-thiazinan-2-ylidene)amino]methyl]benzonitrile
CID 137002759
N-[(4-methyl-3-pyridinyl)methyl]-4,4a,5,6,7,7a-hexahydro-1H-cyclopenta[d][1,3]thiazin-2-imine
CID 136747365
4,5-dimethyl-N-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazinan-2-imine
CID 137002752
3,7-dimethyl-1-(pyridin-3-ylmethyl)-1,4-diazepane
CID 64870565
3-methyl-1-(pyridin-3-ylmethyl)piperazine
CID 64832187
3-[(4-methylcyclohexyl)oxymethyl]pyridine
CID 142207375
5-methyl-N-(pyridin-3-ylmethyl)thiolan-3-amine
CID 79941881
3-methyl-8-(pyridin-3-ylmethyl)-3,8-diazabicyclo[3.2.1]octane
CID 175732632
N,N-diethyl-2-[(4-methyl-1,3-thiazolidin-2-ylidene)amino]-1-phenylethanamine
CID 135934573

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-2-imine?
The IUPAC name of 4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-2-imine (CID 135934658) is 4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-2-imine.
What is the SMILES notation for 4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-2-imine?
The canonical SMILES for 4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-2-imine is CC1CS/C(=N/Cc2cccnc2)N1.
What is the InChIKey of 4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-2-imine?
The InChIKey is CVVJCANNHXUZLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3S/c1-8-7-14-10(13-8)12-6-9-3-2-4-11-5-9/h2-5,8H,6-7H2,1H3,(H,12,13).
What are the key properties of 4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-2-imine?
4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-2-imine has a molecular weight of 207.30 g/mol, XLogP of 1.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-2-imine is sourced from PubChem (CID 135934658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).