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

C10H18N2S — CID 2376062

IUPACN-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine
SMILESC[C@H]1CCCC[C@@H]1NC1=NCCS1
InChIInChI=1S/C10H18N2S/c1-8-4-2-3-5-9(8)12-10-11-6-7-13-10/h8-9H,2-7H2,1H3,(H,11,12)/t8-,9-/m0/s1
InChIKeyAFOLMFKYZXWSRG-IUCAKERBSA-N
MW198.33 g/mol
LogP2.26
Rot. Bonds1

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

N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 2376062) has the molecular formula C10H18N2S and a molecular weight of 198.33 g/mol. Its IUPAC name is N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID2376062
Molecular FormulaC10H18N2S
Molecular Weight198.33 g/mol
Exact Mass198.12
IUPAC NameN-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine
SMILESC[C@H]1CCCC[C@@H]1NC1=NCCS1
InChIInChI=1S/C10H18N2S/c1-8-4-2-3-5-9(8)12-10-11-6-7-13-10/h8-9H,2-7H2,1H3,(H,11,12)/t8-,9-/m0/s1
InChIKeyAFOLMFKYZXWSRG-IUCAKERBSA-N
XLogP2.26
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.33
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylcyclohexyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 3792463
5-methyl-N-(2-methylcyclopentyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 65035158
N-(1,3-dimethylpiperidin-4-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 114505060
5-[[(1R,2S)-2-methylcyclohexyl]amino]-3H-1,3,4-thiadiazole-2-thione
CID 2375960
N-(2-methyloxolan-3-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 82729287
N-(2-cyclopentylpropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 130014375
N-(2-methylcyclopentyl)-3,4-dihydro-2H-pyrrol-5-amine
CID 79503706
N-piperidin-4-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 115016981
1-methyl-N-(2-methylcyclohexyl)tetrazol-5-amine
CID 61225669
1-methyl-N-(2-methylcyclohexyl)imidazol-2-amine
CID 62132741
N-(1-methylpiperidin-4-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 43373637
5-methyl-N-(2-methylcyclohexyl)pyrimidin-2-amine
CID 63208068

Frequently Asked Questions

What is the IUPAC name of N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine (CID 2376062) is N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine is C[C@H]1CCCC[C@@H]1NC1=NCCS1.
What is the InChIKey of N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is AFOLMFKYZXWSRG-IUCAKERBSA-N. The full InChI is InChI=1S/C10H18N2S/c1-8-4-2-3-5-9(8)12-10-11-6-7-13-10/h8-9H,2-7H2,1H3,(H,11,12)/t8-,9-/m0/s1.
What are the key properties of N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine?
N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 198.33 g/mol, XLogP of 2.26, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S,2S)-2-methylcyclohexyl]-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 2376062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).