2,6-dimethyl-2-piperidin-1-ylhept-6-en-3-ol

C14H27NO — CID 114473932

IUPAC2,6-dimethyl-2-piperidin-1-ylhept-6-en-3-ol
SMILESC=C(C)CCC(O)C(C)(C)N1CCCCC1
InChIInChI=1S/C14H27NO/c1-12(2)8-9-13(16)14(3,4)15-10-6-5-7-11-15/h13,16H,1,5-11H2,2-4H3
InChIKeyFKSQGCZQPVRDHT-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.97
Rot. Bonds5

About 2,6-dimethyl-2-piperidin-1-ylhept-6-en-3-ol

2,6-dimethyl-2-piperidin-1-ylhept-6-en-3-ol (PubChem CID 114473932) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 2,6-dimethyl-2-piperidin-1-ylhept-6-en-3-ol.

Molecular Properties

Compound Name2,6-dimethyl-2-piperidin-1-ylhept-6-en-3-ol
PubChem CID114473932
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name2,6-dimethyl-2-piperidin-1-ylhept-6-en-3-ol
SMILESC=C(C)CCC(O)C(C)(C)N1CCCCC1
InChIInChI=1S/C14H27NO/c1-12(2)8-9-13(16)14(3,4)15-10-6-5-7-11-15/h13,16H,1,5-11H2,2-4H3
InChIKeyFKSQGCZQPVRDHT-UHFFFAOYSA-N
XLogP2.97
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.97
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

2,2,6,6-Tetramethyl-1-prop-2-enylpiperidin-3-ol
CID 19868181
1-Cyclopropyl-3-methyl-1-piperidin-1-ylbut-3-en-2-ol
CID 91042850
1-Ethyl-2-methyl-5-(2-methylprop-2-enyl)piperidin-4-ol
CID 123603830
2-Piperidin-1-yl-2-propylhept-6-en-1-ol
CID 142826359
2,2,6,6-Tetramethyl-1-(2-methylprop-2-enyl)piperidin-4-ol
CID 21445609
2-Methyl-2-piperidin-1-ylheptan-3-ol
CID 79045153
2-Methyl-2-piperidin-1-yloct-7-en-3-ol
CID 79045315
2-Methyl-2-piperidin-1-ylhept-6-en-3-ol
CID 79045394
2-Methyl-5-methylidene-2-piperidin-1-ylheptan-3-ol
CID 79045765
2-Methyl-2-piperidin-1-ylhex-5-en-3-ol
CID 79045985
2-(Dimethylamino)-2-methyloct-7-en-3-ol
CID 79047756
2-(Dimethylamino)-2-methyl-5-methylideneheptan-3-ol
CID 79047892

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-2-piperidin-1-ylhept-6-en-3-ol?
The IUPAC name of 2,6-dimethyl-2-piperidin-1-ylhept-6-en-3-ol (CID 114473932) is 2,6-dimethyl-2-piperidin-1-ylhept-6-en-3-ol.
What is the SMILES notation for 2,6-dimethyl-2-piperidin-1-ylhept-6-en-3-ol?
The canonical SMILES for 2,6-dimethyl-2-piperidin-1-ylhept-6-en-3-ol is C=C(C)CCC(O)C(C)(C)N1CCCCC1.
What is the InChIKey of 2,6-dimethyl-2-piperidin-1-ylhept-6-en-3-ol?
The InChIKey is FKSQGCZQPVRDHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-12(2)8-9-13(16)14(3,4)15-10-6-5-7-11-15/h13,16H,1,5-11H2,2-4H3.
What are the key properties of 2,6-dimethyl-2-piperidin-1-ylhept-6-en-3-ol?
2,6-dimethyl-2-piperidin-1-ylhept-6-en-3-ol has a molecular weight of 225.38 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-2-piperidin-1-ylhept-6-en-3-ol is sourced from PubChem (CID 114473932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).