(4S,5S)-4-ethyl-5-methyl-4,5-dihydro-1,3-thiazol-2-amine

C6H12N2S — CID 130756036

IUPAC(4S,5S)-4-ethyl-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC[C@@H]1N=C(N)S[C@H]1C
InChIInChI=1S/C6H12N2S/c1-3-5-4(2)9-6(7)8-5/h4-5H,3H2,1-2H3,(H2,7,8)/t4-,5-/m0/s1
InChIKeyYDPRRYNKXBHEEC-WHFBIAKZSA-N
MW144.24 g/mol
LogP1.22
Rot. Bonds1

About (4S,5S)-4-ethyl-5-methyl-4,5-dihydro-1,3-thiazol-2-amine

(4S,5S)-4-ethyl-5-methyl-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 130756036) has the molecular formula C6H12N2S and a molecular weight of 144.24 g/mol. Its IUPAC name is (4S,5S)-4-ethyl-5-methyl-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name(4S,5S)-4-ethyl-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID130756036
Molecular FormulaC6H12N2S
Molecular Weight144.24 g/mol
Exact Mass144.07
IUPAC Name(4S,5S)-4-ethyl-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC[C@@H]1N=C(N)S[C@H]1C
InChIInChI=1S/C6H12N2S/c1-3-5-4(2)9-6(7)8-5/h4-5H,3H2,1-2H3,(H2,7,8)/t4-,5-/m0/s1
InChIKeyYDPRRYNKXBHEEC-WHFBIAKZSA-N
XLogP1.22
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.24
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-Butyl-thiazolidin-(2E)-ylideneamine
CID 9812839
(4r,5r)-5-Ethyl-2-imino-4-methyl-1,3-thiazolidine
CID 9795163
5-Methyl-4,5-dihydro-1,3-thiazol-2-amine
CID 544920
2-Amino-4-ethyl-2-thiazoline
CID 15468264
2-Amino-5-methyl-2-thiazoline hydrobromide
CID 129831691
2-(2-Aminopropyl)-1-methyl-2-thiopseudourea
CID 6451601
(4S,5R,6R)-5-fluoro-4,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 118441148
(4S,5S)-5-fluoro-4-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 118441149
Thiazole, 4,5-dihydro-4-methyl-2-amino-
CID 568239
(4S,5S)-4,5-dimethyl-4,5-dihydro-1,3-thiazol-2-amine
CID 40531190
cis-2-Amino-4,5-dimethyl-2-thiazoline
CID 40531207
(4R)-4-(fluoromethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 144464888

Frequently Asked Questions

What is the IUPAC name of (4S,5S)-4-ethyl-5-methyl-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of (4S,5S)-4-ethyl-5-methyl-4,5-dihydro-1,3-thiazol-2-amine (CID 130756036) is (4S,5S)-4-ethyl-5-methyl-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for (4S,5S)-4-ethyl-5-methyl-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for (4S,5S)-4-ethyl-5-methyl-4,5-dihydro-1,3-thiazol-2-amine is CC[C@@H]1N=C(N)S[C@H]1C.
What is the InChIKey of (4S,5S)-4-ethyl-5-methyl-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is YDPRRYNKXBHEEC-WHFBIAKZSA-N. The full InChI is InChI=1S/C6H12N2S/c1-3-5-4(2)9-6(7)8-5/h4-5H,3H2,1-2H3,(H2,7,8)/t4-,5-/m0/s1.
What are the key properties of (4S,5S)-4-ethyl-5-methyl-4,5-dihydro-1,3-thiazol-2-amine?
(4S,5S)-4-ethyl-5-methyl-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 144.24 g/mol, XLogP of 1.22, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S,5S)-4-ethyl-5-methyl-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 130756036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).