N-tert-butyl-6,7-dihydro-4H-thiopyrano[4,3-d][1,3]thiazol-2-amine

C10H16N2S2 — CID 62941268

IUPACN-tert-butyl-6,7-dihydro-4H-thiopyrano[4,3-d][1,3]thiazol-2-amine
SMILESCC(C)(C)Nc1nc2c(s1)CSCC2
InChIInChI=1S/C10H16N2S2/c1-10(2,3)12-9-11-7-4-5-13-6-8(7)14-9/h4-6H2,1-3H3,(H,11,12)
InChIKeyUHPQCYSZDAZDJZ-UHFFFAOYSA-N
MW228.39 g/mol
LogP3.14
Rot. Bonds1

About N-tert-butyl-6,7-dihydro-4H-thiopyrano[4,3-d][1,3]thiazol-2-amine

N-tert-butyl-6,7-dihydro-4H-thiopyrano[4,3-d][1,3]thiazol-2-amine (PubChem CID 62941268) has the molecular formula C10H16N2S2 and a molecular weight of 228.39 g/mol. Its IUPAC name is N-tert-butyl-6,7-dihydro-4H-thiopyrano[4,3-d][1,3]thiazol-2-amine.

Molecular Properties

Compound NameN-tert-butyl-6,7-dihydro-4H-thiopyrano[4,3-d][1,3]thiazol-2-amine
PubChem CID62941268
Molecular FormulaC10H16N2S2
Molecular Weight228.39 g/mol
Exact Mass228.08
IUPAC NameN-tert-butyl-6,7-dihydro-4H-thiopyrano[4,3-d][1,3]thiazol-2-amine
SMILESCC(C)(C)Nc1nc2c(s1)CSCC2
InChIInChI=1S/C10H16N2S2/c1-10(2,3)12-9-11-7-4-5-13-6-8(7)14-9/h4-6H2,1-3H3,(H,11,12)
InChIKeyUHPQCYSZDAZDJZ-UHFFFAOYSA-N
XLogP3.14
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.39
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-6,7-dihydro-4H-thiopyrano[4,3-d][1,3]thiazol-2-amine?
The IUPAC name of N-tert-butyl-6,7-dihydro-4H-thiopyrano[4,3-d][1,3]thiazol-2-amine (CID 62941268) is N-tert-butyl-6,7-dihydro-4H-thiopyrano[4,3-d][1,3]thiazol-2-amine.
What is the SMILES notation for N-tert-butyl-6,7-dihydro-4H-thiopyrano[4,3-d][1,3]thiazol-2-amine?
The canonical SMILES for N-tert-butyl-6,7-dihydro-4H-thiopyrano[4,3-d][1,3]thiazol-2-amine is CC(C)(C)Nc1nc2c(s1)CSCC2.
What is the InChIKey of N-tert-butyl-6,7-dihydro-4H-thiopyrano[4,3-d][1,3]thiazol-2-amine?
The InChIKey is UHPQCYSZDAZDJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2S2/c1-10(2,3)12-9-11-7-4-5-13-6-8(7)14-9/h4-6H2,1-3H3,(H,11,12).
What are the key properties of N-tert-butyl-6,7-dihydro-4H-thiopyrano[4,3-d][1,3]thiazol-2-amine?
N-tert-butyl-6,7-dihydro-4H-thiopyrano[4,3-d][1,3]thiazol-2-amine has a molecular weight of 228.39 g/mol, XLogP of 3.14, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-6,7-dihydro-4H-thiopyrano[4,3-d][1,3]thiazol-2-amine is sourced from PubChem (CID 62941268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).