4-(dimethylamino)-4-phenyl-1-(1-phenylethyl)cyclohexan-1-ol

C22H29NO — CID 154131714

IUPAC4-(dimethylamino)-4-phenyl-1-(1-phenylethyl)cyclohexan-1-ol
SMILESCC(c1ccccc1)C1(O)CCC(c2ccccc2)(N(C)C)CC1
InChIInChI=1S/C22H29NO/c1-18(19-10-6-4-7-11-19)22(24)16-14-21(15-17-22,23(2)3)20-12-8-5-9-13-20/h4-13,18,24H,14-17H2,1-3H3
InChIKeyYDLGKWPWLCXXET-UHFFFAOYSA-N
MW323.48 g/mol
LogP4.55
Rot. Bonds4

About 4-(dimethylamino)-4-phenyl-1-(1-phenylethyl)cyclohexan-1-ol

4-(dimethylamino)-4-phenyl-1-(1-phenylethyl)cyclohexan-1-ol (PubChem CID 154131714) has the molecular formula C22H29NO and a molecular weight of 323.48 g/mol. Its IUPAC name is 4-(dimethylamino)-4-phenyl-1-(1-phenylethyl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(dimethylamino)-4-phenyl-1-(1-phenylethyl)cyclohexan-1-ol
PubChem CID154131714
Molecular FormulaC22H29NO
Molecular Weight323.48 g/mol
Exact Mass323.22
IUPAC Name4-(dimethylamino)-4-phenyl-1-(1-phenylethyl)cyclohexan-1-ol
SMILESCC(c1ccccc1)C1(O)CCC(c2ccccc2)(N(C)C)CC1
InChIInChI=1S/C22H29NO/c1-18(19-10-6-4-7-11-19)22(24)16-14-21(15-17-22,23(2)3)20-12-8-5-9-13-20/h4-13,18,24H,14-17H2,1-3H3
InChIKeyYDLGKWPWLCXXET-UHFFFAOYSA-N
XLogP4.55
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.48
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-benzyl-4-(dimethylamino)-4-phenylcyclohexan-1-ol;hydrochloride
CID 118711155
1-amino-4-(dimethylamino)-4-phenylcyclohexane-1-carboxylic acid
CID 130202617
(NZ)-N-[[4-(dimethylamino)-1-methyl-4-phenylcyclohexyl]methylidene]hydroxylamine
CID 87523816
1-[1-(3-fluorophenyl)ethyl]cyclopentan-1-ol
CID 144756929
1-N,1-N-dimethyl-1-phenylcyclohexane-1,4-diamine;hydrochloride
CID 68895646
(2S,3R)-1-[4-(dimethylamino)-4-phenylpiperidin-1-yl]-2-(methylaminomethyl)-3-phenylbutan-1-one
CID 156758850
2-amino-1-(1-phenylethyl)cyclopentan-1-ol
CID 67750994
2-[4-(dimethylamino)-4-phenylpiperidin-1-yl]phenol
CID 138687800
4-(dimethylamino)-4-phenylcyclohexane-1-carboxamide
CID 21082136
1-(1-phenylethyl)cyclopropan-1-amine;hydrochloride
CID 138987875
4-(4-chlorophenyl)-4-(dimethylamino)-1-(2-phenylethyl)cyclohexan-1-ol;hydrochloride
CID 10135239
2-chloro-N-methyl-N-(1-phenylcyclopropyl)acetamide
CID 166430545

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-4-phenyl-1-(1-phenylethyl)cyclohexan-1-ol?
The IUPAC name of 4-(dimethylamino)-4-phenyl-1-(1-phenylethyl)cyclohexan-1-ol (CID 154131714) is 4-(dimethylamino)-4-phenyl-1-(1-phenylethyl)cyclohexan-1-ol.
What is the SMILES notation for 4-(dimethylamino)-4-phenyl-1-(1-phenylethyl)cyclohexan-1-ol?
The canonical SMILES for 4-(dimethylamino)-4-phenyl-1-(1-phenylethyl)cyclohexan-1-ol is CC(c1ccccc1)C1(O)CCC(c2ccccc2)(N(C)C)CC1.
What is the InChIKey of 4-(dimethylamino)-4-phenyl-1-(1-phenylethyl)cyclohexan-1-ol?
The InChIKey is YDLGKWPWLCXXET-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29NO/c1-18(19-10-6-4-7-11-19)22(24)16-14-21(15-17-22,23(2)3)20-12-8-5-9-13-20/h4-13,18,24H,14-17H2,1-3H3.
What are the key properties of 4-(dimethylamino)-4-phenyl-1-(1-phenylethyl)cyclohexan-1-ol?
4-(dimethylamino)-4-phenyl-1-(1-phenylethyl)cyclohexan-1-ol has a molecular weight of 323.48 g/mol, XLogP of 4.55, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-4-phenyl-1-(1-phenylethyl)cyclohexan-1-ol is sourced from PubChem (CID 154131714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).