(2R,4S,6R)-2-ethenyl-6-methylpiperidin-4-ol

C8H15NO — CID 25231927

IUPAC(2R,4S,6R)-2-ethenyl-6-methylpiperidin-4-ol
SMILESC=C[C@H]1C[C@@H](O)C[C@@H](C)N1
InChIInChI=1S/C8H15NO/c1-3-7-5-8(10)4-6(2)9-7/h3,6-10H,1,4-5H2,2H3/t6-,7+,8+/m1/s1
InChIKeyVSMRWEQQYQONRU-CSMHCCOUSA-N
MW141.21 g/mol
LogP0.67
Rot. Bonds1

About (2R,4S,6R)-2-ethenyl-6-methylpiperidin-4-ol

(2R,4S,6R)-2-ethenyl-6-methylpiperidin-4-ol (PubChem CID 25231927) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is (2R,4S,6R)-2-ethenyl-6-methylpiperidin-4-ol.

Molecular Properties

Compound Name(2R,4S,6R)-2-ethenyl-6-methylpiperidin-4-ol
PubChem CID25231927
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name(2R,4S,6R)-2-ethenyl-6-methylpiperidin-4-ol
SMILESC=C[C@H]1C[C@@H](O)C[C@@H](C)N1
InChIInChI=1S/C8H15NO/c1-3-7-5-8(10)4-6(2)9-7/h3,6-10H,1,4-5H2,2H3/t6-,7+,8+/m1/s1
InChIKeyVSMRWEQQYQONRU-CSMHCCOUSA-N
XLogP0.67
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2S,6S)-2,6-dimethylpiperidin-4-ol;hydrochloride
CID 164888528
(2S,6R)-2,6-dimethylpiperidin-4-ol;hydrochloride
CID 164888527
2-methyl-6-propylpiperidin-4-ol
CID 85238690
2-ethenyl-6-methylpiperidine
CID 53405891
tert-butyl formate;2,6-dimethylpiperidin-4-ol
CID 174682531
2-(methoxymethyl)-6-methylpiperidin-4-ol
CID 89196247
(3R,5R)-3-ethenyl-5-methyl-1-propan-2-ylpiperazine
CID 167025725
(2S,4S)-2,4-dimethylazetidine;hydrochloride
CID 135392273
(2R,4S,6R)-2-ethenyl-6-methyloxan-4-ol
CID 138966744
(2R,4S,6R)-2-methyl-6-phenylpiperidin-4-ol
CID 15480231
(2S,4R,6S)-2-methyl-6-phenylpiperidin-4-ol
CID 82656257
2-methyl-6-phenylpiperidin-4-ol
CID 5254857

Frequently Asked Questions

What is the IUPAC name of (2R,4S,6R)-2-ethenyl-6-methylpiperidin-4-ol?
The IUPAC name of (2R,4S,6R)-2-ethenyl-6-methylpiperidin-4-ol (CID 25231927) is (2R,4S,6R)-2-ethenyl-6-methylpiperidin-4-ol.
What is the SMILES notation for (2R,4S,6R)-2-ethenyl-6-methylpiperidin-4-ol?
The canonical SMILES for (2R,4S,6R)-2-ethenyl-6-methylpiperidin-4-ol is C=C[C@H]1C[C@@H](O)C[C@@H](C)N1.
What is the InChIKey of (2R,4S,6R)-2-ethenyl-6-methylpiperidin-4-ol?
The InChIKey is VSMRWEQQYQONRU-CSMHCCOUSA-N. The full InChI is InChI=1S/C8H15NO/c1-3-7-5-8(10)4-6(2)9-7/h3,6-10H,1,4-5H2,2H3/t6-,7+,8+/m1/s1.
What are the key properties of (2R,4S,6R)-2-ethenyl-6-methylpiperidin-4-ol?
(2R,4S,6R)-2-ethenyl-6-methylpiperidin-4-ol has a molecular weight of 141.21 g/mol, XLogP of 0.67, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4S,6R)-2-ethenyl-6-methylpiperidin-4-ol is sourced from PubChem (CID 25231927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).