N-tert-butyl-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine

C11H22N2S — CID 106351079

IUPACN-tert-butyl-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCC(C)C1CCSC(NC(C)(C)C)=N1
InChIInChI=1S/C11H22N2S/c1-8(2)9-6-7-14-10(12-9)13-11(3,4)5/h8-9H,6-7H2,1-5H3,(H,12,13)
InChIKeyBPFICESMOYDQCX-UHFFFAOYSA-N
MW214.38 g/mol
LogP2.89
Rot. Bonds1

About N-tert-butyl-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine

N-tert-butyl-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine (PubChem CID 106351079) has the molecular formula C11H22N2S and a molecular weight of 214.38 g/mol. Its IUPAC name is N-tert-butyl-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine.

Molecular Properties

Compound NameN-tert-butyl-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine
PubChem CID106351079
Molecular FormulaC11H22N2S
Molecular Weight214.38 g/mol
Exact Mass214.15
IUPAC NameN-tert-butyl-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCC(C)C1CCSC(NC(C)(C)C)=N1
InChIInChI=1S/C11H22N2S/c1-8(2)9-6-7-14-10(12-9)13-11(3,4)5/h8-9H,6-7H2,1-5H3,(H,12,13)
InChIKeyBPFICESMOYDQCX-UHFFFAOYSA-N
XLogP2.89
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.38
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-propan-2-yl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 106352465
N-tert-butyl-2-[(4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-yl)amino]propanamide
CID 106352124
N-(dicyclopropylmethyl)-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 114177191
N-cycloheptyl-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 106351355
N-(1-methylcyclohexyl)-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 106351650
N-(4-methylpiperazin-1-yl)-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 106352080
N-[1-(5-methylthiophen-2-yl)ethyl]-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 114177187
N-(2-methylphenyl)-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 114177148
1-N,1-N,4-trimethyl-2-N-(4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-yl)pentane-1,2-diamine
CID 106351563
4-propan-2-yl-N-(2,3,5-trifluorophenyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 106351748
4-propan-2-yl-N-[3-(trifluoromethyl)phenyl]-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 106351157
1-methyl-5-[(4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-yl)amino]piperidin-2-one
CID 106351890

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine?
The IUPAC name of N-tert-butyl-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine (CID 106351079) is N-tert-butyl-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine.
What is the SMILES notation for N-tert-butyl-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine?
The canonical SMILES for N-tert-butyl-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine is CC(C)C1CCSC(NC(C)(C)C)=N1.
What is the InChIKey of N-tert-butyl-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine?
The InChIKey is BPFICESMOYDQCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2S/c1-8(2)9-6-7-14-10(12-9)13-11(3,4)5/h8-9H,6-7H2,1-5H3,(H,12,13).
What are the key properties of N-tert-butyl-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine?
N-tert-butyl-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine has a molecular weight of 214.38 g/mol, XLogP of 2.89, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine is sourced from PubChem (CID 106351079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).