4-ethyl-N-pentyl-1,3-thiazolidin-2-imine

C10H20N2S — CID 135934584

IUPAC4-ethyl-N-pentyl-1,3-thiazolidin-2-imine
SMILESCCCCC/N=C1/NC(CC)CS1
InChIInChI=1S/C10H20N2S/c1-3-5-6-7-11-10-12-9(4-2)8-13-10/h9H,3-8H2,1-2H3,(H,11,12)
InChIKeyPOALSKWYPVRHBP-UHFFFAOYSA-N
MW200.35 g/mol
LogP2.65
Rot. Bonds5

About 4-ethyl-N-pentyl-1,3-thiazolidin-2-imine

4-ethyl-N-pentyl-1,3-thiazolidin-2-imine (PubChem CID 135934584) has the molecular formula C10H20N2S and a molecular weight of 200.35 g/mol. Its IUPAC name is 4-ethyl-N-pentyl-1,3-thiazolidin-2-imine.

Molecular Properties

Compound Name4-ethyl-N-pentyl-1,3-thiazolidin-2-imine
PubChem CID135934584
Molecular FormulaC10H20N2S
Molecular Weight200.35 g/mol
Exact Mass200.13
IUPAC Name4-ethyl-N-pentyl-1,3-thiazolidin-2-imine
SMILESCCCCC/N=C1/NC(CC)CS1
InChIInChI=1S/C10H20N2S/c1-3-5-6-7-11-10-12-9(4-2)8-13-10/h9H,3-8H2,1-2H3,(H,11,12)
InChIKeyPOALSKWYPVRHBP-UHFFFAOYSA-N
XLogP2.65
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.35
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-ethyl-N-octyl-1,3-thiazinan-2-imine
CID 136933398
4-ethyl-N-(4-methoxybutyl)-1,3-thiazolidin-2-imine
CID 135973739
4-ethyl-N-(7-methyloctyl)-1,3-thiazolidin-2-imine
CID 136701829
N,N-diethyl-3-[(4-ethyl-1,3-thiazolidin-2-ylidene)amino]propan-1-amine
CID 135934622
4-benzyl-N-octyl-1,3-thiazolidin-2-imine
CID 136920389
N-[2-[(4-ethyl-1,3-thiazolidin-2-ylidene)amino]ethyl]methanesulfonamide
CID 135938395
4-ethyl-N-[3-(triazol-1-yl)propyl]-1,3-thiazolidin-2-imine
CID 136824831
N-(3-butoxypropyl)-4-(2-methylpropyl)-1,3-thiazolidin-2-imine
CID 137002731
4-ethyl-N-[(3-methylcyclopentyl)methyl]-1,3-thiazolidin-2-imine
CID 136867396
4-ethyl-N-[2-(1-methylpiperidin-4-yl)ethyl]-1,3-thiazolidin-2-imine
CID 137004296
4-ethyl-N-(3-propoxypropyl)-1,3-thiazinan-2-imine
CID 136933402
4-ethyl-N-(oxan-4-ylmethyl)-1,3-thiazolidin-2-imine
CID 135998385

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-pentyl-1,3-thiazolidin-2-imine?
The IUPAC name of 4-ethyl-N-pentyl-1,3-thiazolidin-2-imine (CID 135934584) is 4-ethyl-N-pentyl-1,3-thiazolidin-2-imine.
What is the SMILES notation for 4-ethyl-N-pentyl-1,3-thiazolidin-2-imine?
The canonical SMILES for 4-ethyl-N-pentyl-1,3-thiazolidin-2-imine is CCCCC/N=C1/NC(CC)CS1.
What is the InChIKey of 4-ethyl-N-pentyl-1,3-thiazolidin-2-imine?
The InChIKey is POALSKWYPVRHBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2S/c1-3-5-6-7-11-10-12-9(4-2)8-13-10/h9H,3-8H2,1-2H3,(H,11,12).
What are the key properties of 4-ethyl-N-pentyl-1,3-thiazolidin-2-imine?
4-ethyl-N-pentyl-1,3-thiazolidin-2-imine has a molecular weight of 200.35 g/mol, XLogP of 2.65, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-pentyl-1,3-thiazolidin-2-imine is sourced from PubChem (CID 135934584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).