(4S)-4-methyl-4-phenyl-5,6-dihydro-1,3-thiazin-2-amine

C11H14N2S — CID 59374749

IUPAC(4S)-4-methyl-4-phenyl-5,6-dihydro-1,3-thiazin-2-amine
SMILESC[C@@]1(c2ccccc2)CCSC(N)=N1
InChIInChI=1S/C11H14N2S/c1-11(7-8-14-10(12)13-11)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H2,12,13)/t11-/m0/s1
InChIKeyJLGLPAHFIFVDIC-NSHDSACASA-N
MW206.31 g/mol
LogP2.35
Rot. Bonds1

About (4S)-4-methyl-4-phenyl-5,6-dihydro-1,3-thiazin-2-amine

(4S)-4-methyl-4-phenyl-5,6-dihydro-1,3-thiazin-2-amine (PubChem CID 59374749) has the molecular formula C11H14N2S and a molecular weight of 206.31 g/mol. Its IUPAC name is (4S)-4-methyl-4-phenyl-5,6-dihydro-1,3-thiazin-2-amine.

Molecular Properties

Compound Name(4S)-4-methyl-4-phenyl-5,6-dihydro-1,3-thiazin-2-amine
PubChem CID59374749
Molecular FormulaC11H14N2S
Molecular Weight206.31 g/mol
Exact Mass206.09
IUPAC Name(4S)-4-methyl-4-phenyl-5,6-dihydro-1,3-thiazin-2-amine
SMILESC[C@@]1(c2ccccc2)CCSC(N)=N1
InChIInChI=1S/C11H14N2S/c1-11(7-8-14-10(12)13-11)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H2,12,13)/t11-/m0/s1
InChIKeyJLGLPAHFIFVDIC-NSHDSACASA-N
XLogP2.35
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4S)-4-methyl-4-phenyl-5,6-dihydro-1,3-thiazin-2-amine?
The IUPAC name of (4S)-4-methyl-4-phenyl-5,6-dihydro-1,3-thiazin-2-amine (CID 59374749) is (4S)-4-methyl-4-phenyl-5,6-dihydro-1,3-thiazin-2-amine.
What is the SMILES notation for (4S)-4-methyl-4-phenyl-5,6-dihydro-1,3-thiazin-2-amine?
The canonical SMILES for (4S)-4-methyl-4-phenyl-5,6-dihydro-1,3-thiazin-2-amine is C[C@@]1(c2ccccc2)CCSC(N)=N1.
What is the InChIKey of (4S)-4-methyl-4-phenyl-5,6-dihydro-1,3-thiazin-2-amine?
The InChIKey is JLGLPAHFIFVDIC-NSHDSACASA-N. The full InChI is InChI=1S/C11H14N2S/c1-11(7-8-14-10(12)13-11)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H2,12,13)/t11-/m0/s1.
What are the key properties of (4S)-4-methyl-4-phenyl-5,6-dihydro-1,3-thiazin-2-amine?
(4S)-4-methyl-4-phenyl-5,6-dihydro-1,3-thiazin-2-amine has a molecular weight of 206.31 g/mol, XLogP of 2.35, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-methyl-4-phenyl-5,6-dihydro-1,3-thiazin-2-amine is sourced from PubChem (CID 59374749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).