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

C6H12N2S — CID 40543534

IUPAC(4R)-N,N,4-trimethyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESC[C@@H]1CSC(N(C)C)=N1
InChIInChI=1S/C6H12N2S/c1-5-4-9-6(7-5)8(2)3/h5H,4H2,1-3H3/t5-/m1/s1
InChIKeyNAUHWJYUCJXLMI-RXMQYKEDSA-N
MW144.24 g/mol
LogP1.04
Rot. Bonds

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

(4R)-N,N,4-trimethyl-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 40543534) has the molecular formula C6H12N2S and a molecular weight of 144.24 g/mol. Its IUPAC name is (4R)-N,N,4-trimethyl-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name(4R)-N,N,4-trimethyl-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID40543534
Molecular FormulaC6H12N2S
Molecular Weight144.24 g/mol
Exact Mass144.07
IUPAC Name(4R)-N,N,4-trimethyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESC[C@@H]1CSC(N(C)C)=N1
InChIInChI=1S/C6H12N2S/c1-5-4-9-6(7-5)8(2)3/h5H,4H2,1-3H3/t5-/m1/s1
InChIKeyNAUHWJYUCJXLMI-RXMQYKEDSA-N
XLogP1.04
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.24
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4R)-N,N,4-trimethyl-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of (4R)-N,N,4-trimethyl-4,5-dihydro-1,3-thiazol-2-amine (CID 40543534) is (4R)-N,N,4-trimethyl-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for (4R)-N,N,4-trimethyl-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for (4R)-N,N,4-trimethyl-4,5-dihydro-1,3-thiazol-2-amine is C[C@@H]1CSC(N(C)C)=N1.
What is the InChIKey of (4R)-N,N,4-trimethyl-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is NAUHWJYUCJXLMI-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H12N2S/c1-5-4-9-6(7-5)8(2)3/h5H,4H2,1-3H3/t5-/m1/s1.
What are the key properties of (4R)-N,N,4-trimethyl-4,5-dihydro-1,3-thiazol-2-amine?
(4R)-N,N,4-trimethyl-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 144.24 g/mol, XLogP of 1.04, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-N,N,4-trimethyl-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 40543534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).