5-methyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-ol

C16H28N2O — CID 64766250

IUPAC5-methyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-ol
SMILESCCCn1ccnc1C(C)(C)C1CCC(C)CC1O
InChIInChI=1S/C16H28N2O/c1-5-9-18-10-8-17-15(18)16(3,4)13-7-6-12(2)11-14(13)19/h8,10,12-14,19H,5-7,9,11H2,1-4H3
InChIKeyRUZWVEIJZOJYIF-UHFFFAOYSA-N
MW264.41 g/mol
LogP3.37
Rot. Bonds4

About 5-methyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-ol

5-methyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-ol (PubChem CID 64766250) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is 5-methyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-ol.

Molecular Properties

Compound Name5-methyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-ol
PubChem CID64766250
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name5-methyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-ol
SMILESCCCn1ccnc1C(C)(C)C1CCC(C)CC1O
InChIInChI=1S/C16H28N2O/c1-5-9-18-10-8-17-15(18)16(3,4)13-7-6-12(2)11-14(13)19/h8,10,12-14,19H,5-7,9,11H2,1-4H3
InChIKeyRUZWVEIJZOJYIF-UHFFFAOYSA-N
XLogP3.37
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-ol?
The IUPAC name of 5-methyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-ol (CID 64766250) is 5-methyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-ol.
What is the SMILES notation for 5-methyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-ol?
The canonical SMILES for 5-methyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-ol is CCCn1ccnc1C(C)(C)C1CCC(C)CC1O.
What is the InChIKey of 5-methyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-ol?
The InChIKey is RUZWVEIJZOJYIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-5-9-18-10-8-17-15(18)16(3,4)13-7-6-12(2)11-14(13)19/h8,10,12-14,19H,5-7,9,11H2,1-4H3.
What are the key properties of 5-methyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-ol?
5-methyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-ol has a molecular weight of 264.41 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-ol is sourced from PubChem (CID 64766250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).