(4R,5S)-N,N,4,5-tetramethyl-4,5-dihydro-1,3-thiazol-2-amine

C7H14N2S — CID 40543594

IUPAC(4R,5S)-N,N,4,5-tetramethyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESC[C@@H]1SC(N(C)C)=N[C@@H]1C
InChIInChI=1S/C7H14N2S/c1-5-6(2)10-7(8-5)9(3)4/h5-6H,1-4H3/t5-,6+/m1/s1
InChIKeyVAWPWVLQCZLBPV-RITPCOANSA-N
MW158.27 g/mol
LogP1.43
Rot. Bonds

About (4R,5S)-N,N,4,5-tetramethyl-4,5-dihydro-1,3-thiazol-2-amine

(4R,5S)-N,N,4,5-tetramethyl-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 40543594) has the molecular formula C7H14N2S and a molecular weight of 158.27 g/mol. Its IUPAC name is (4R,5S)-N,N,4,5-tetramethyl-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name(4R,5S)-N,N,4,5-tetramethyl-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID40543594
Molecular FormulaC7H14N2S
Molecular Weight158.27 g/mol
Exact Mass158.09
IUPAC Name(4R,5S)-N,N,4,5-tetramethyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESC[C@@H]1SC(N(C)C)=N[C@@H]1C
InChIInChI=1S/C7H14N2S/c1-5-6(2)10-7(8-5)9(3)4/h5-6H,1-4H3/t5-,6+/m1/s1
InChIKeyVAWPWVLQCZLBPV-RITPCOANSA-N
XLogP1.43
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.27
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4R,5S)-N,N,4,5-tetramethyl-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of (4R,5S)-N,N,4,5-tetramethyl-4,5-dihydro-1,3-thiazol-2-amine (CID 40543594) is (4R,5S)-N,N,4,5-tetramethyl-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for (4R,5S)-N,N,4,5-tetramethyl-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for (4R,5S)-N,N,4,5-tetramethyl-4,5-dihydro-1,3-thiazol-2-amine is C[C@@H]1SC(N(C)C)=N[C@@H]1C.
What is the InChIKey of (4R,5S)-N,N,4,5-tetramethyl-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is VAWPWVLQCZLBPV-RITPCOANSA-N. The full InChI is InChI=1S/C7H14N2S/c1-5-6(2)10-7(8-5)9(3)4/h5-6H,1-4H3/t5-,6+/m1/s1.
What are the key properties of (4R,5S)-N,N,4,5-tetramethyl-4,5-dihydro-1,3-thiazol-2-amine?
(4R,5S)-N,N,4,5-tetramethyl-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 158.27 g/mol, XLogP of 1.43, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,5S)-N,N,4,5-tetramethyl-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 40543594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).