4-(dimethylamino)-4-(4-methylphenyl)-1-phenylcyclohexan-1-ol

C21H27NO — CID 134134392

IUPAC4-(dimethylamino)-4-(4-methylphenyl)-1-phenylcyclohexan-1-ol
SMILESCc1ccc(C2(N(C)C)CCC(O)(c3ccccc3)CC2)cc1
InChIInChI=1S/C21H27NO/c1-17-9-11-18(12-10-17)20(22(2)3)13-15-21(23,16-14-20)19-7-5-4-6-8-19/h4-12,23H,13-16H2,1-3H3
InChIKeyWIMXPUJBSYIQGL-UHFFFAOYSA-N
MW309.45 g/mol
LogP4.21
Rot. Bonds3

About 4-(dimethylamino)-4-(4-methylphenyl)-1-phenylcyclohexan-1-ol

4-(dimethylamino)-4-(4-methylphenyl)-1-phenylcyclohexan-1-ol (PubChem CID 134134392) has the molecular formula C21H27NO and a molecular weight of 309.45 g/mol. Its IUPAC name is 4-(dimethylamino)-4-(4-methylphenyl)-1-phenylcyclohexan-1-ol.

Molecular Properties

Compound Name4-(dimethylamino)-4-(4-methylphenyl)-1-phenylcyclohexan-1-ol
PubChem CID134134392
Molecular FormulaC21H27NO
Molecular Weight309.45 g/mol
Exact Mass309.21
IUPAC Name4-(dimethylamino)-4-(4-methylphenyl)-1-phenylcyclohexan-1-ol
SMILESCc1ccc(C2(N(C)C)CCC(O)(c3ccccc3)CC2)cc1
InChIInChI=1S/C21H27NO/c1-17-9-11-18(12-10-17)20(22(2)3)13-15-21(23,16-14-20)19-7-5-4-6-8-19/h4-12,23H,13-16H2,1-3H3
InChIKeyWIMXPUJBSYIQGL-UHFFFAOYSA-N
XLogP4.21
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.45
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-Phenyl-1-(phenylmethyl)-4-piperidinol
CID 97333
1-(1-Phenylcyclohexyl)-4-phenyl-4-piperidinol
CID 131754
1-Benzhydryl-4-p-tolylpiperidin-4-ol
CID 9924923
4-Phenyl-1-(1-phenylethyl)piperidin-4-ol
CID 9925737
1-Benzhydryl-4-phenylpiperidin-4-ol
CID 10269001
4-Phenyl-1-(1-phenylpropyl)piperidin-4-ol
CID 44426806
4-Phenyl-1-(1-phenylbutyl)piperidin-4-ol
CID 44426807
4-Phenyl-1-(1-phenylpentyl)piperidin-4-ol
CID 44426808
4-Piperidinol, 4-(4-methylphenyl)-1-(phenylmethyl)-, hydrochloride (1:1)
CID 198607
4-Phenyl-1-(1-phenylhexyl)piperidin-4-ol
CID 44426810
4-Phenyl-1-(1-phenylheptyl)piperidin-4-ol
CID 44426812
1-(1,2-Diphenylethyl)-4-phenylpiperidin-4-ol
CID 44426814

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-4-(4-methylphenyl)-1-phenylcyclohexan-1-ol?
The IUPAC name of 4-(dimethylamino)-4-(4-methylphenyl)-1-phenylcyclohexan-1-ol (CID 134134392) is 4-(dimethylamino)-4-(4-methylphenyl)-1-phenylcyclohexan-1-ol.
What is the SMILES notation for 4-(dimethylamino)-4-(4-methylphenyl)-1-phenylcyclohexan-1-ol?
The canonical SMILES for 4-(dimethylamino)-4-(4-methylphenyl)-1-phenylcyclohexan-1-ol is Cc1ccc(C2(N(C)C)CCC(O)(c3ccccc3)CC2)cc1.
What is the InChIKey of 4-(dimethylamino)-4-(4-methylphenyl)-1-phenylcyclohexan-1-ol?
The InChIKey is WIMXPUJBSYIQGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27NO/c1-17-9-11-18(12-10-17)20(22(2)3)13-15-21(23,16-14-20)19-7-5-4-6-8-19/h4-12,23H,13-16H2,1-3H3.
What are the key properties of 4-(dimethylamino)-4-(4-methylphenyl)-1-phenylcyclohexan-1-ol?
4-(dimethylamino)-4-(4-methylphenyl)-1-phenylcyclohexan-1-ol has a molecular weight of 309.45 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-4-(4-methylphenyl)-1-phenylcyclohexan-1-ol is sourced from PubChem (CID 134134392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).