N-(2,2-dimethyloxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine

C10H18N2OS — CID 83028593

IUPACN-(2,2-dimethyloxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC1(C)CC(NC2=NCCS2)CCO1
InChIInChI=1S/C10H18N2OS/c1-10(2)7-8(3-5-13-10)12-9-11-4-6-14-9/h8H,3-7H2,1-2H3,(H,11,12)
InChIKeySAZUXCCKCJRRAK-UHFFFAOYSA-N
MW214.33 g/mol
LogP1.64
Rot. Bonds1

About N-(2,2-dimethyloxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine

N-(2,2-dimethyloxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 83028593) has the molecular formula C10H18N2OS and a molecular weight of 214.33 g/mol. Its IUPAC name is N-(2,2-dimethyloxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(2,2-dimethyloxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID83028593
Molecular FormulaC10H18N2OS
Molecular Weight214.33 g/mol
Exact Mass214.11
IUPAC NameN-(2,2-dimethyloxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC1(C)CC(NC2=NCCS2)CCO1
InChIInChI=1S/C10H18N2OS/c1-10(2)7-8(3-5-13-10)12-9-11-4-6-14-9/h8H,3-7H2,1-2H3,(H,11,12)
InChIKeySAZUXCCKCJRRAK-UHFFFAOYSA-N
XLogP1.64
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.33
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyloxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-(2,2-dimethyloxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine (CID 83028593) is N-(2,2-dimethyloxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-(2,2-dimethyloxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-(2,2-dimethyloxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine is CC1(C)CC(NC2=NCCS2)CCO1.
What is the InChIKey of N-(2,2-dimethyloxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is SAZUXCCKCJRRAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2OS/c1-10(2)7-8(3-5-13-10)12-9-11-4-6-14-9/h8H,3-7H2,1-2H3,(H,11,12).
What are the key properties of N-(2,2-dimethyloxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine?
N-(2,2-dimethyloxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 214.33 g/mol, XLogP of 1.64, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyloxan-4-yl)-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 83028593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).