1-cyclohexyl-3-(1,3-thiazol-2-yl)propan-2-amine

C12H20N2S — CID 105014924

IUPAC1-cyclohexyl-3-(1,3-thiazol-2-yl)propan-2-amine
SMILESNC(Cc1nccs1)CC1CCCCC1
InChIInChI=1S/C12H20N2S/c13-11(9-12-14-6-7-15-12)8-10-4-2-1-3-5-10/h6-7,10-11H,1-5,8-9,13H2
InChIKeyXCUGQAPOFRYDPS-UHFFFAOYSA-N
MW224.37 g/mol
LogP2.98
Rot. Bonds4

About 1-cyclohexyl-3-(1,3-thiazol-2-yl)propan-2-amine

1-cyclohexyl-3-(1,3-thiazol-2-yl)propan-2-amine (PubChem CID 105014924) has the molecular formula C12H20N2S and a molecular weight of 224.37 g/mol. Its IUPAC name is 1-cyclohexyl-3-(1,3-thiazol-2-yl)propan-2-amine.

Molecular Properties

Compound Name1-cyclohexyl-3-(1,3-thiazol-2-yl)propan-2-amine
PubChem CID105014924
Molecular FormulaC12H20N2S
Molecular Weight224.37 g/mol
Exact Mass224.13
IUPAC Name1-cyclohexyl-3-(1,3-thiazol-2-yl)propan-2-amine
SMILESNC(Cc1nccs1)CC1CCCCC1
InChIInChI=1S/C12H20N2S/c13-11(9-12-14-6-7-15-12)8-10-4-2-1-3-5-10/h6-7,10-11H,1-5,8-9,13H2
InChIKeyXCUGQAPOFRYDPS-UHFFFAOYSA-N
XLogP2.98
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.37
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-cycloheptyl-2-(1,3-thiazol-2-yl)ethyl]hydrazine
CID 105232079
[1-cyclooctyl-2-(1,3-thiazol-2-yl)ethyl]hydrazine
CID 105255195
1-cyclohexyl-2-(1,3-thiazol-2-yl)ethanol
CID 79824321
1-(2-bicyclo[2.2.1]heptanyl)-3-(1,3-thiazol-2-yl)propan-2-amine
CID 105015334
1-cycloheptyl-3-thiophen-2-ylpropan-2-amine
CID 114458094
1-cycloheptyl-3-(1,3-thiazol-5-yl)propan-2-amine
CID 105030739
[1-(7-bicyclo[4.1.0]heptanyl)-2-(1,3-thiazol-2-yl)ethyl]hydrazine
CID 105324654
2-(2-bromo-2-cyclopropylethyl)-1,3-thiazole
CID 63353715
4-ethoxy-1-(1,3-thiazol-2-yl)butan-2-amine
CID 105169291
1,3-dicyclopentylpropan-2-amine
CID 58122660
1-cyclohexyl-3-(5-methyl-2-pyridinyl)propan-2-amine
CID 66446718
1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-amine
CID 103169254

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-3-(1,3-thiazol-2-yl)propan-2-amine?
The IUPAC name of 1-cyclohexyl-3-(1,3-thiazol-2-yl)propan-2-amine (CID 105014924) is 1-cyclohexyl-3-(1,3-thiazol-2-yl)propan-2-amine.
What is the SMILES notation for 1-cyclohexyl-3-(1,3-thiazol-2-yl)propan-2-amine?
The canonical SMILES for 1-cyclohexyl-3-(1,3-thiazol-2-yl)propan-2-amine is NC(Cc1nccs1)CC1CCCCC1.
What is the InChIKey of 1-cyclohexyl-3-(1,3-thiazol-2-yl)propan-2-amine?
The InChIKey is XCUGQAPOFRYDPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2S/c13-11(9-12-14-6-7-15-12)8-10-4-2-1-3-5-10/h6-7,10-11H,1-5,8-9,13H2.
What are the key properties of 1-cyclohexyl-3-(1,3-thiazol-2-yl)propan-2-amine?
1-cyclohexyl-3-(1,3-thiazol-2-yl)propan-2-amine has a molecular weight of 224.37 g/mol, XLogP of 2.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-(1,3-thiazol-2-yl)propan-2-amine is sourced from PubChem (CID 105014924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).