cyclohexyl-[4-[(1-methylbenzimidazol-2-yl)methoxy]phenyl]methanol

C22H26N2O2 — CID 10641616

IUPACcyclohexyl-[4-[(1-methylbenzimidazol-2-yl)methoxy]phenyl]methanol
SMILESCn1c(COc2ccc(C(O)C3CCCCC3)cc2)nc2ccccc21
InChIInChI=1S/C22H26N2O2/c1-24-20-10-6-5-9-19(20)23-21(24)15-26-18-13-11-17(12-14-18)22(25)16-7-3-2-4-8-16/h5-6,9-14,16,22,25H,2-4,7-8,15H2,1H3
InChIKeyLGTCRUWXMFZKGC-UHFFFAOYSA-N
MW350.46 g/mol
LogP4.77
Rot. Bonds5

About cyclohexyl-[4-[(1-methylbenzimidazol-2-yl)methoxy]phenyl]methanol

cyclohexyl-[4-[(1-methylbenzimidazol-2-yl)methoxy]phenyl]methanol (PubChem CID 10641616) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is cyclohexyl-[4-[(1-methylbenzimidazol-2-yl)methoxy]phenyl]methanol.

Molecular Properties

Compound Namecyclohexyl-[4-[(1-methylbenzimidazol-2-yl)methoxy]phenyl]methanol
PubChem CID10641616
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC Namecyclohexyl-[4-[(1-methylbenzimidazol-2-yl)methoxy]phenyl]methanol
SMILESCn1c(COc2ccc(C(O)C3CCCCC3)cc2)nc2ccccc21
InChIInChI=1S/C22H26N2O2/c1-24-20-10-6-5-9-19(20)23-21(24)15-26-18-13-11-17(12-14-18)22(25)16-7-3-2-4-8-16/h5-6,9-14,16,22,25H,2-4,7-8,15H2,1H3
InChIKeyLGTCRUWXMFZKGC-UHFFFAOYSA-N
XLogP4.77
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

O-[cyclohexyl-[4-[(1-methylbenzimidazol-2-yl)methoxy]phenyl]methyl]hydroxylamine
CID 10595008
(2E)-2-[cyclohexyl-[4-[(1-methylbenzimidazol-2-yl)methoxy]phenyl]methoxy]iminopropanoic acid
CID 10646537
(1R)-1-(4-ethoxyphenyl)-2-(1-methylbenzimidazol-2-yl)ethanol
CID 763733
3-[4-[(1-methylbenzimidazol-2-yl)methoxy]phenyl]-2-sulfanylpropanamide
CID 141073954
2-[(4-chlorophenoxy)methyl]-1-(2-cyclohexylethyl)benzimidazole
CID 3631447
1-(1-methylbenzimidazol-2-yl)-3-phenoxypropan-2-ol
CID 79755905
4-cyclopentyl-1-(1-methylbenzimidazol-2-yl)butan-2-ol
CID 115818515
cyclohexyl-[4-[(6-fluoroquinolin-2-yl)methoxy]phenyl]methanol
CID 11793224
2-[(1-methylbenzimidazol-2-yl)methyl]cyclohexan-1-ol
CID 79750115
1-cyclobutyl-2-(1-methylbenzimidazol-2-yl)ethanamine
CID 79750402
(R)-(4-ethoxyphenyl)-(1-methylbenzimidazol-2-yl)methanol
CID 797343
1-cycloheptyl-3-(1-methylbenzimidazol-2-yl)propan-2-amine
CID 105007666

Frequently Asked Questions

What is the IUPAC name of cyclohexyl-[4-[(1-methylbenzimidazol-2-yl)methoxy]phenyl]methanol?
The IUPAC name of cyclohexyl-[4-[(1-methylbenzimidazol-2-yl)methoxy]phenyl]methanol (CID 10641616) is cyclohexyl-[4-[(1-methylbenzimidazol-2-yl)methoxy]phenyl]methanol.
What is the SMILES notation for cyclohexyl-[4-[(1-methylbenzimidazol-2-yl)methoxy]phenyl]methanol?
The canonical SMILES for cyclohexyl-[4-[(1-methylbenzimidazol-2-yl)methoxy]phenyl]methanol is Cn1c(COc2ccc(C(O)C3CCCCC3)cc2)nc2ccccc21.
What is the InChIKey of cyclohexyl-[4-[(1-methylbenzimidazol-2-yl)methoxy]phenyl]methanol?
The InChIKey is LGTCRUWXMFZKGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-24-20-10-6-5-9-19(20)23-21(24)15-26-18-13-11-17(12-14-18)22(25)16-7-3-2-4-8-16/h5-6,9-14,16,22,25H,2-4,7-8,15H2,1H3.
What are the key properties of cyclohexyl-[4-[(1-methylbenzimidazol-2-yl)methoxy]phenyl]methanol?
cyclohexyl-[4-[(1-methylbenzimidazol-2-yl)methoxy]phenyl]methanol has a molecular weight of 350.46 g/mol, XLogP of 4.77, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-[4-[(1-methylbenzimidazol-2-yl)methoxy]phenyl]methanol is sourced from PubChem (CID 10641616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).