(1S,8R)-8-(dimethylamino)cyclooct-4-en-1-ol

C10H19NO — CID 124665894

IUPAC(1S,8R)-8-(dimethylamino)cyclooct-4-en-1-ol
SMILESCN(C)[C@@H]1CCC=CCC[C@@H]1O
InChIInChI=1S/C10H19NO/c1-11(2)9-7-5-3-4-6-8-10(9)12/h3-4,9-10,12H,5-8H2,1-2H3/t9-,10+/m1/s1
InChIKeyPCYULBQAZMOGHN-ZJUUUORDSA-N
MW169.27 g/mol
LogP1.41
Rot. Bonds1

About (1S,8R)-8-(dimethylamino)cyclooct-4-en-1-ol

(1S,8R)-8-(dimethylamino)cyclooct-4-en-1-ol (PubChem CID 124665894) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is (1S,8R)-8-(dimethylamino)cyclooct-4-en-1-ol.

Molecular Properties

Compound Name(1S,8R)-8-(dimethylamino)cyclooct-4-en-1-ol
PubChem CID124665894
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name(1S,8R)-8-(dimethylamino)cyclooct-4-en-1-ol
SMILESCN(C)[C@@H]1CCC=CCC[C@@H]1O
InChIInChI=1S/C10H19NO/c1-11(2)9-7-5-3-4-6-8-10(9)12/h3-4,9-10,12H,5-8H2,1-2H3/t9-,10+/m1/s1
InChIKeyPCYULBQAZMOGHN-ZJUUUORDSA-N
XLogP1.41
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(1R,4Z,8R)-8-(N-methylanilino)cyclooct-4-en-1-ol
CID 10585628
(3S,4S)-4-(dimethylamino)piperidin-3-ol;hydrochloride
CID 156592163
(E)-but-2-enedioic acid;trans-(1S,2S)-2-(dimethylamino)cyclopentan-1-ol
CID 70589053
(2R)-3-(dimethylamino)cyclohexane-1,2-diol;3-(dimethylamino)cyclohexane-1,2-diol
CID 157254014
but-2-enedioic acid;2-(dimethylamino)cycloheptan-1-ol;hydrate
CID 70589651
(3R,4R)-4-(dimethylamino)pyrrolidin-3-ol
CID 58007276
(1S,4E,8E,12R)-12-chlorocyclododeca-4,8-dien-1-ol
CID 13049643
(3R,4S)-4-(dimethylamino)pyrrolidin-3-ol;dihydrochloride
CID 112756828
2-[(2-hydroxycyclohexyl)-methylamino]cycloheptan-1-ol
CID 102635791
(1S,2R,5E,9Z,12R)-13-oxabicyclo[10.1.0]trideca-5,9-dien-2-ol
CID 102330516
2-[[cyclohex-3-en-1-ylmethyl(methyl)amino]methyl]cyclopentan-1-ol
CID 115883971
cyclohex-3-en-1-yl(methyl)carbamic acid
CID 141218160

Frequently Asked Questions

What is the IUPAC name of (1S,8R)-8-(dimethylamino)cyclooct-4-en-1-ol?
The IUPAC name of (1S,8R)-8-(dimethylamino)cyclooct-4-en-1-ol (CID 124665894) is (1S,8R)-8-(dimethylamino)cyclooct-4-en-1-ol.
What is the SMILES notation for (1S,8R)-8-(dimethylamino)cyclooct-4-en-1-ol?
The canonical SMILES for (1S,8R)-8-(dimethylamino)cyclooct-4-en-1-ol is CN(C)[C@@H]1CCC=CCC[C@@H]1O.
What is the InChIKey of (1S,8R)-8-(dimethylamino)cyclooct-4-en-1-ol?
The InChIKey is PCYULBQAZMOGHN-ZJUUUORDSA-N. The full InChI is InChI=1S/C10H19NO/c1-11(2)9-7-5-3-4-6-8-10(9)12/h3-4,9-10,12H,5-8H2,1-2H3/t9-,10+/m1/s1.
What are the key properties of (1S,8R)-8-(dimethylamino)cyclooct-4-en-1-ol?
(1S,8R)-8-(dimethylamino)cyclooct-4-en-1-ol has a molecular weight of 169.27 g/mol, XLogP of 1.41, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,8R)-8-(dimethylamino)cyclooct-4-en-1-ol is sourced from PubChem (CID 124665894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).