N-tert-butyl-3-propan-2-yl-1,3-thiazolidin-2-imine

C10H20N2S — CID 134106735

IUPACN-tert-butyl-3-propan-2-yl-1,3-thiazolidin-2-imine
SMILESCC(C)N1CCS/C1=N\C(C)(C)C
InChIInChI=1S/C10H20N2S/c1-8(2)12-6-7-13-9(12)11-10(3,4)5/h8H,6-7H2,1-5H3/b11-9-
InChIKeyBAXPHNWTXLWIOX-LUAWRHEFSA-N
MW200.35 g/mol
LogP2.60
Rot. Bonds1

About N-tert-butyl-3-propan-2-yl-1,3-thiazolidin-2-imine

N-tert-butyl-3-propan-2-yl-1,3-thiazolidin-2-imine (PubChem CID 134106735) has the molecular formula C10H20N2S and a molecular weight of 200.35 g/mol. Its IUPAC name is N-tert-butyl-3-propan-2-yl-1,3-thiazolidin-2-imine.

Molecular Properties

Compound NameN-tert-butyl-3-propan-2-yl-1,3-thiazolidin-2-imine
PubChem CID134106735
Molecular FormulaC10H20N2S
Molecular Weight200.35 g/mol
Exact Mass200.13
IUPAC NameN-tert-butyl-3-propan-2-yl-1,3-thiazolidin-2-imine
SMILESCC(C)N1CCS/C1=N\C(C)(C)C
InChIInChI=1S/C10H20N2S/c1-8(2)12-6-7-13-9(12)11-10(3,4)5/h8H,6-7H2,1-5H3/b11-9-
InChIKeyBAXPHNWTXLWIOX-LUAWRHEFSA-N
XLogP2.60
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.35
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N,N-diethyl-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
CID 12718866
[3-(Propan-2-yl)-1,3-thiazolidin-2-ylidene]cyanamide
CID 14893646
(3-Tert-butyl-1,3-thiazolidin-2-ylidene)cyanamide
CID 15163845
N-methyl-3-propan-2-yl-1,3-thiazolidin-2-imine
CID 89097031
[3-(1-Methylcyclopropyl)-1,3-thiazolidin-2-ylidene]cyanamide
CID 91186785
N-(3-methylbutyl)-3-propan-2-yl-1,3-thiazolidin-2-imine
CID 132269575
N-(2-methylpropyl)-3-propan-2-yl-1,3-thiazolidin-2-imine
CID 132269580
N-butyl-3-propan-2-yl-1,3-thiazolidin-2-imine
CID 145121141
N,5-dimethyl-N-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 156447235
N-tert-butyl-N-methyl-4,5-dihydro-1,3-thiazol-2-amine
CID 168085851
(4,5-Dimethyl(1,3-thiazolin-2-yl))diethylamine
CID 3343562
Diethyl(4-methyl(1,3-thiazolin-2-yl))amine
CID 3343563

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-3-propan-2-yl-1,3-thiazolidin-2-imine?
The IUPAC name of N-tert-butyl-3-propan-2-yl-1,3-thiazolidin-2-imine (CID 134106735) is N-tert-butyl-3-propan-2-yl-1,3-thiazolidin-2-imine.
What is the SMILES notation for N-tert-butyl-3-propan-2-yl-1,3-thiazolidin-2-imine?
The canonical SMILES for N-tert-butyl-3-propan-2-yl-1,3-thiazolidin-2-imine is CC(C)N1CCS/C1=N\C(C)(C)C.
What is the InChIKey of N-tert-butyl-3-propan-2-yl-1,3-thiazolidin-2-imine?
The InChIKey is BAXPHNWTXLWIOX-LUAWRHEFSA-N. The full InChI is InChI=1S/C10H20N2S/c1-8(2)12-6-7-13-9(12)11-10(3,4)5/h8H,6-7H2,1-5H3/b11-9-.
What are the key properties of N-tert-butyl-3-propan-2-yl-1,3-thiazolidin-2-imine?
N-tert-butyl-3-propan-2-yl-1,3-thiazolidin-2-imine has a molecular weight of 200.35 g/mol, XLogP of 2.60, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-3-propan-2-yl-1,3-thiazolidin-2-imine is sourced from PubChem (CID 134106735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).