1-[4-(dimethylamino)cyclohexyl]propan-1-ol

C11H23NO — CID 123513782

IUPAC1-[4-(dimethylamino)cyclohexyl]propan-1-ol
SMILESCCC(O)C1CCC(N(C)C)CC1
InChIInChI=1S/C11H23NO/c1-4-11(13)9-5-7-10(8-6-9)12(2)3/h9-11,13H,4-8H2,1-3H3
InChIKeySBCRIYSGKLCKBZ-UHFFFAOYSA-N
MW185.31 g/mol
LogP1.88
Rot. Bonds3

About 1-[4-(dimethylamino)cyclohexyl]propan-1-ol

1-[4-(dimethylamino)cyclohexyl]propan-1-ol (PubChem CID 123513782) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 1-[4-(dimethylamino)cyclohexyl]propan-1-ol.

Molecular Properties

Compound Name1-[4-(dimethylamino)cyclohexyl]propan-1-ol
PubChem CID123513782
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name1-[4-(dimethylamino)cyclohexyl]propan-1-ol
SMILESCCC(O)C1CCC(N(C)C)CC1
InChIInChI=1S/C11H23NO/c1-4-11(13)9-5-7-10(8-6-9)12(2)3/h9-11,13H,4-8H2,1-3H3
InChIKeySBCRIYSGKLCKBZ-UHFFFAOYSA-N
XLogP1.88
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

{4-[Methyl(2,2,2-trifluoroethyl)amino]cyclohexyl}methanol
CID 75433495
[4-[3-Fluoropropyl(methyl)amino]cyclohexyl]methanol
CID 91659920
[4-[Methyl(5,5,5-trifluoropentyl)amino]cyclohexyl]methanol
CID 109883023
4-Ethyl-3-[(3-fluoropropyl)(methyl)amino]cyclohexan-1-ol
CID 165498071
3-[(3-Fluoropropyl)(methyl)amino]-4-propylcyclohexan-1-ol
CID 165787540
(1R,2R)-1-cyclohexyl-3-(dimethylamino)-2-methylpropan-1-ol
CID 11816477
1-Cyclohexyl-2-(dimethylamino)ethanol
CID 14528558
(1S)-1-cyclohexyl-2-(dimethylamino)ethanol
CID 14528559
[4-(Diethylamino)cyclohexyl]methanol
CID 18000543
cis-4-(Dimethylamino)cyclohexanemethanol
CID 18000552
[3-(2-Hydroxyethyl)cyclohexyl]-trimethylazanium bromide
CID 19377294
[3-(2-Hydroxyethyl)cyclohexyl]-trimethylazanium
CID 19377295

Frequently Asked Questions

What is the IUPAC name of 1-[4-(dimethylamino)cyclohexyl]propan-1-ol?
The IUPAC name of 1-[4-(dimethylamino)cyclohexyl]propan-1-ol (CID 123513782) is 1-[4-(dimethylamino)cyclohexyl]propan-1-ol.
What is the SMILES notation for 1-[4-(dimethylamino)cyclohexyl]propan-1-ol?
The canonical SMILES for 1-[4-(dimethylamino)cyclohexyl]propan-1-ol is CCC(O)C1CCC(N(C)C)CC1.
What is the InChIKey of 1-[4-(dimethylamino)cyclohexyl]propan-1-ol?
The InChIKey is SBCRIYSGKLCKBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-4-11(13)9-5-7-10(8-6-9)12(2)3/h9-11,13H,4-8H2,1-3H3.
What are the key properties of 1-[4-(dimethylamino)cyclohexyl]propan-1-ol?
1-[4-(dimethylamino)cyclohexyl]propan-1-ol has a molecular weight of 185.31 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(dimethylamino)cyclohexyl]propan-1-ol is sourced from PubChem (CID 123513782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).