4-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]cyclohexan-1-ol

C12H20N2OS — CID 106594624

IUPAC4-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]cyclohexan-1-ol
SMILESCc1csc(CCNC2CCC(O)CC2)n1
InChIInChI=1S/C12H20N2OS/c1-9-8-16-12(14-9)6-7-13-10-2-4-11(15)5-3-10/h8,10-11,13,15H,2-7H2,1H3
InChIKeyVAJYHJMMJDSULU-UHFFFAOYSA-N
MW240.37 g/mol
LogP1.89
Rot. Bonds4

About 4-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]cyclohexan-1-ol

4-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]cyclohexan-1-ol (PubChem CID 106594624) has the molecular formula C12H20N2OS and a molecular weight of 240.37 g/mol. Its IUPAC name is 4-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]cyclohexan-1-ol
PubChem CID106594624
Molecular FormulaC12H20N2OS
Molecular Weight240.37 g/mol
Exact Mass240.13
IUPAC Name4-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]cyclohexan-1-ol
SMILESCc1csc(CCNC2CCC(O)CC2)n1
InChIInChI=1S/C12H20N2OS/c1-9-8-16-12(14-9)6-7-13-10-2-4-11(15)5-3-10/h8,10-11,13,15H,2-7H2,1H3
InChIKeyVAJYHJMMJDSULU-UHFFFAOYSA-N
XLogP1.89
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.37
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidin-4-amine
CID 63239020
3-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]cyclobutan-1-amine
CID 104859672
N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]thiolan-3-amine
CID 63238611
N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]-1-propan-2-ylpiperidin-4-amine
CID 63238570
1-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]cyclobutane-1,3-diamine
CID 80562480
3,5-dimethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]cyclohexan-1-amine
CID 64752621
N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]oxolan-3-amine
CID 63335162
N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 63238545
1-ethyl-3-(4-hydroxycyclohexyl)-2-[3-(4-methyl-1,3-thiazol-2-yl)propyl]guanidine;hydroiodide
CID 111190941
5,5-dimethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]thian-3-amine
CID 79958007
2,2-dimethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]cyclopentan-1-amine
CID 79856277
3-(4-bromophenyl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]cyclobutan-1-amine
CID 63238923

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]cyclohexan-1-ol?
The IUPAC name of 4-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]cyclohexan-1-ol (CID 106594624) is 4-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]cyclohexan-1-ol.
What is the SMILES notation for 4-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]cyclohexan-1-ol?
The canonical SMILES for 4-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]cyclohexan-1-ol is Cc1csc(CCNC2CCC(O)CC2)n1.
What is the InChIKey of 4-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]cyclohexan-1-ol?
The InChIKey is VAJYHJMMJDSULU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2OS/c1-9-8-16-12(14-9)6-7-13-10-2-4-11(15)5-3-10/h8,10-11,13,15H,2-7H2,1H3.
What are the key properties of 4-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]cyclohexan-1-ol?
4-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]cyclohexan-1-ol has a molecular weight of 240.37 g/mol, XLogP of 1.89, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]cyclohexan-1-ol is sourced from PubChem (CID 106594624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).