1-[1-hydroxy-2-(1-propylimidazol-2-yl)ethyl]-4-methylcyclohexan-1-ol

C15H26N2O2 — CID 103452429

IUPAC1-[1-hydroxy-2-(1-propylimidazol-2-yl)ethyl]-4-methylcyclohexan-1-ol
SMILESCCCn1ccnc1CC(O)C1(O)CCC(C)CC1
InChIInChI=1S/C15H26N2O2/c1-3-9-17-10-8-16-14(17)11-13(18)15(19)6-4-12(2)5-7-15/h8,10,12-13,18-19H,3-7,9,11H2,1-2H3
InChIKeyJWRDYRHZJFMONM-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.14
Rot. Bonds5

About 1-[1-hydroxy-2-(1-propylimidazol-2-yl)ethyl]-4-methylcyclohexan-1-ol

1-[1-hydroxy-2-(1-propylimidazol-2-yl)ethyl]-4-methylcyclohexan-1-ol (PubChem CID 103452429) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 1-[1-hydroxy-2-(1-propylimidazol-2-yl)ethyl]-4-methylcyclohexan-1-ol.

Molecular Properties

Compound Name1-[1-hydroxy-2-(1-propylimidazol-2-yl)ethyl]-4-methylcyclohexan-1-ol
PubChem CID103452429
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name1-[1-hydroxy-2-(1-propylimidazol-2-yl)ethyl]-4-methylcyclohexan-1-ol
SMILESCCCn1ccnc1CC(O)C1(O)CCC(C)CC1
InChIInChI=1S/C15H26N2O2/c1-3-9-17-10-8-16-14(17)11-13(18)15(19)6-4-12(2)5-7-15/h8,10,12-13,18-19H,3-7,9,11H2,1-2H3
InChIKeyJWRDYRHZJFMONM-UHFFFAOYSA-N
XLogP2.14
TPSA58.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4,4-dimethylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanol
CID 79752511
1-(1-methoxycyclopentyl)-2-(1-propylimidazol-2-yl)ethanol
CID 104610436
2-(1-propylimidazol-2-yl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanol
CID 115821078
1-(2-methylcyclopentyl)-2-(1-propylimidazol-2-yl)ethanamine
CID 107189999
1-(3-methyloxolan-2-yl)-2-(1-propylimidazol-2-yl)ethanol
CID 115821151
1-(oxan-2-yl)-2-(1-propylimidazol-2-yl)ethanol
CID 115821107
N-methyl-1-(3-methylcyclopentyl)-2-(1-propylimidazol-2-yl)ethanamine
CID 79762352
1-(propylamino)-3-(1-propylimidazol-2-yl)propan-2-ol
CID 79761462
1-[(1-propylimidazol-2-yl)methyl]cycloheptan-1-ol
CID 79744670
1-(2,2-dimethylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanamine
CID 107189998
4-ethyl-1-[[(1-propylimidazol-2-yl)methylamino]methyl]cyclohexan-1-ol
CID 65116048
1-[1-hydroxy-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]-4-methylcyclohexan-1-ol
CID 103452462

Frequently Asked Questions

What is the IUPAC name of 1-[1-hydroxy-2-(1-propylimidazol-2-yl)ethyl]-4-methylcyclohexan-1-ol?
The IUPAC name of 1-[1-hydroxy-2-(1-propylimidazol-2-yl)ethyl]-4-methylcyclohexan-1-ol (CID 103452429) is 1-[1-hydroxy-2-(1-propylimidazol-2-yl)ethyl]-4-methylcyclohexan-1-ol.
What is the SMILES notation for 1-[1-hydroxy-2-(1-propylimidazol-2-yl)ethyl]-4-methylcyclohexan-1-ol?
The canonical SMILES for 1-[1-hydroxy-2-(1-propylimidazol-2-yl)ethyl]-4-methylcyclohexan-1-ol is CCCn1ccnc1CC(O)C1(O)CCC(C)CC1.
What is the InChIKey of 1-[1-hydroxy-2-(1-propylimidazol-2-yl)ethyl]-4-methylcyclohexan-1-ol?
The InChIKey is JWRDYRHZJFMONM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-3-9-17-10-8-16-14(17)11-13(18)15(19)6-4-12(2)5-7-15/h8,10,12-13,18-19H,3-7,9,11H2,1-2H3.
What are the key properties of 1-[1-hydroxy-2-(1-propylimidazol-2-yl)ethyl]-4-methylcyclohexan-1-ol?
1-[1-hydroxy-2-(1-propylimidazol-2-yl)ethyl]-4-methylcyclohexan-1-ol has a molecular weight of 266.38 g/mol, XLogP of 2.14, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-hydroxy-2-(1-propylimidazol-2-yl)ethyl]-4-methylcyclohexan-1-ol is sourced from PubChem (CID 103452429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).