[1-(dimethylamino)cyclohexyl]-(4-methoxyphenyl)methanol

C16H25NO2 — CID 79067098

IUPAC[1-(dimethylamino)cyclohexyl]-(4-methoxyphenyl)methanol
SMILESCOc1ccc(C(O)C2(N(C)C)CCCCC2)cc1
InChIInChI=1S/C16H25NO2/c1-17(2)16(11-5-4-6-12-16)15(18)13-7-9-14(19-3)10-8-13/h7-10,15,18H,4-6,11-12H2,1-3H3
InChIKeyGVHAALMKSBJILR-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.99
Rot. Bonds4

About [1-(dimethylamino)cyclohexyl]-(4-methoxyphenyl)methanol

[1-(dimethylamino)cyclohexyl]-(4-methoxyphenyl)methanol (PubChem CID 79067098) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is [1-(dimethylamino)cyclohexyl]-(4-methoxyphenyl)methanol.

Molecular Properties

Compound Name[1-(dimethylamino)cyclohexyl]-(4-methoxyphenyl)methanol
PubChem CID79067098
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name[1-(dimethylamino)cyclohexyl]-(4-methoxyphenyl)methanol
SMILESCOc1ccc(C(O)C2(N(C)C)CCCCC2)cc1
InChIInChI=1S/C16H25NO2/c1-17(2)16(11-5-4-6-12-16)15(18)13-7-9-14(19-3)10-8-13/h7-10,15,18H,4-6,11-12H2,1-3H3
InChIKeyGVHAALMKSBJILR-UHFFFAOYSA-N
XLogP2.99
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(dimethylamino)cycloheptyl]-(4-methylphenyl)methanol
CID 79075014
(2,4-dimethoxyphenyl)-[1-(dimethylamino)cyclohexyl]methanol
CID 79061364
(2,5-dimethoxyphenyl)-[1-(dimethylamino)cyclopentyl]methanol
CID 79067398
[1-(dimethylamino)cyclohexyl]-(3-fluoro-4-methoxyphenyl)methanol
CID 79066938
(4-tert-butylphenyl)-[1-(dimethylamino)cyclopentyl]methanol
CID 79067862
1-[1-(dimethylamino)cyclopentyl]-3-(4-methoxyphenyl)propan-1-ol
CID 79067614
[1-(dimethylamino)cyclopentyl]-(furan-3-yl)methanol
CID 79067235
bis(1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol);hydrochloride
CID 68818348
[1-(dimethylamino)cyclohexyl]-(5-fluoro-2-methoxyphenyl)methanol
CID 82769611
N-[[1-(dimethylamino)cyclopentyl]-(4-methoxyphenyl)methyl]-2,6-dimethylbenzamide
CID 11710660
[1-(dimethylamino)-4-methylcyclohexyl]-(4-ethoxyphenyl)methanol
CID 79061631
(R)-1-adamantyl-(4-methoxyphenyl)methanol
CID 7064962

Frequently Asked Questions

What is the IUPAC name of [1-(dimethylamino)cyclohexyl]-(4-methoxyphenyl)methanol?
The IUPAC name of [1-(dimethylamino)cyclohexyl]-(4-methoxyphenyl)methanol (CID 79067098) is [1-(dimethylamino)cyclohexyl]-(4-methoxyphenyl)methanol.
What is the SMILES notation for [1-(dimethylamino)cyclohexyl]-(4-methoxyphenyl)methanol?
The canonical SMILES for [1-(dimethylamino)cyclohexyl]-(4-methoxyphenyl)methanol is COc1ccc(C(O)C2(N(C)C)CCCCC2)cc1.
What is the InChIKey of [1-(dimethylamino)cyclohexyl]-(4-methoxyphenyl)methanol?
The InChIKey is GVHAALMKSBJILR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-17(2)16(11-5-4-6-12-16)15(18)13-7-9-14(19-3)10-8-13/h7-10,15,18H,4-6,11-12H2,1-3H3.
What are the key properties of [1-(dimethylamino)cyclohexyl]-(4-methoxyphenyl)methanol?
[1-(dimethylamino)cyclohexyl]-(4-methoxyphenyl)methanol has a molecular weight of 263.38 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(dimethylamino)cyclohexyl]-(4-methoxyphenyl)methanol is sourced from PubChem (CID 79067098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).