(5S)-5-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine

C11H20N2S — CID 2363377

IUPAC(5S)-5-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine
SMILESC[C@H]1CN=C(N[C@H]2CCCC[C@@H]2C)S1
InChIInChI=1S/C11H20N2S/c1-8-5-3-4-6-10(8)13-11-12-7-9(2)14-11/h8-10H,3-7H2,1-2H3,(H,12,13)/t8-,9-,10-/m0/s1
InChIKeyJAFZMDNLUBMVJS-GUBZILKMSA-N
MW212.36 g/mol
LogP2.65
Rot. Bonds1

About (5S)-5-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine

(5S)-5-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 2363377) has the molecular formula C11H20N2S and a molecular weight of 212.36 g/mol. Its IUPAC name is (5S)-5-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name(5S)-5-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID2363377
Molecular FormulaC11H20N2S
Molecular Weight212.36 g/mol
Exact Mass212.13
IUPAC Name(5S)-5-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine
SMILESC[C@H]1CN=C(N[C@H]2CCCC[C@@H]2C)S1
InChIInChI=1S/C11H20N2S/c1-8-5-3-4-6-10(8)13-11-12-7-9(2)14-11/h8-10H,3-7H2,1-2H3,(H,12,13)/t8-,9-,10-/m0/s1
InChIKeyJAFZMDNLUBMVJS-GUBZILKMSA-N
XLogP2.65
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.36
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,4-dimethyl-N-(2-methylcyclohexyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 135439906
N-(2-methylcyclohexyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 3792463
N-cyclohexyl-4,5-dihydro-1,3-thiazol-2-amine
CID 568661
N1-(1,3-thiazolan-2-yliden)-3,3,5-trimethylcyclohexan-1-amine
CID 2731009
N-(5-methylheptyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 3705369
N-(2-methylcyclohexyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 5018374
2-Thiazoline, 2-((cyclohexylmethyl)amino)-
CID 3055296
N-Cyclohexyl-4,5-dihydro-5-methyl-2-thiazolamine
CID 2802274
N-cyclohexyl-5,5-dimethyl-4,5-dihydro-1,3-thiazol-2-amine
CID 768206
5-methyl-N-(2-methylcyclohexyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 2999911
N-(1-cyclohexyl-2,2,2-trifluoroethyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 54087907
N-(4,4,4-trifluorobutan-2-yl)-4a,5,6,7,8,8a-hexahydro-4H-3,1-benzothiazin-2-amine
CID 114179099

Frequently Asked Questions

What is the IUPAC name of (5S)-5-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of (5S)-5-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine (CID 2363377) is (5S)-5-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for (5S)-5-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for (5S)-5-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine is C[C@H]1CN=C(N[C@H]2CCCC[C@@H]2C)S1.
What is the InChIKey of (5S)-5-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is JAFZMDNLUBMVJS-GUBZILKMSA-N. The full InChI is InChI=1S/C11H20N2S/c1-8-5-3-4-6-10(8)13-11-12-7-9(2)14-11/h8-10H,3-7H2,1-2H3,(H,12,13)/t8-,9-,10-/m0/s1.
What are the key properties of (5S)-5-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine?
(5S)-5-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 212.36 g/mol, XLogP of 2.65, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-methyl-N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 2363377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).