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

C5H10N2S — CID 40531207

IUPAC(4S,5R)-4,5-dimethyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESC[C@@H]1N=C(N)S[C@@H]1C
InChIInChI=1S/C5H10N2S/c1-3-4(2)8-5(6)7-3/h3-4H,1-2H3,(H2,6,7)/t3-,4+/m0/s1
InChIKeyUFIVPTJXTHOMKS-IUYQGCFVSA-N
MW130.22 g/mol
LogP0.82
Rot. Bonds

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

(4S,5R)-4,5-dimethyl-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 40531207) has the molecular formula C5H10N2S and a molecular weight of 130.22 g/mol. Its IUPAC name is (4S,5R)-4,5-dimethyl-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name(4S,5R)-4,5-dimethyl-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID40531207
Molecular FormulaC5H10N2S
Molecular Weight130.22 g/mol
Exact Mass130.06
IUPAC Name(4S,5R)-4,5-dimethyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESC[C@@H]1N=C(N)S[C@@H]1C
InChIInChI=1S/C5H10N2S/c1-3-4(2)8-5(6)7-3/h3-4H,1-2H3,(H2,6,7)/t3-,4+/m0/s1
InChIKeyUFIVPTJXTHOMKS-IUYQGCFVSA-N
XLogP0.82
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.22
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4S,5R)-4,5-dimethyl-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of (4S,5R)-4,5-dimethyl-4,5-dihydro-1,3-thiazol-2-amine (CID 40531207) is (4S,5R)-4,5-dimethyl-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for (4S,5R)-4,5-dimethyl-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for (4S,5R)-4,5-dimethyl-4,5-dihydro-1,3-thiazol-2-amine is C[C@@H]1N=C(N)S[C@@H]1C.
What is the InChIKey of (4S,5R)-4,5-dimethyl-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is UFIVPTJXTHOMKS-IUYQGCFVSA-N. The full InChI is InChI=1S/C5H10N2S/c1-3-4(2)8-5(6)7-3/h3-4H,1-2H3,(H2,6,7)/t3-,4+/m0/s1.
What are the key properties of (4S,5R)-4,5-dimethyl-4,5-dihydro-1,3-thiazol-2-amine?
(4S,5R)-4,5-dimethyl-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 130.22 g/mol, XLogP of 0.82, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S,5R)-4,5-dimethyl-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 40531207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).