2-ethenyl-1-methylpiperidin-3-ol

C8H15NO — CID 139998908

IUPAC2-ethenyl-1-methylpiperidin-3-ol
SMILESC=CC1C(O)CCCN1C
InChIInChI=1S/C8H15NO/c1-3-7-8(10)5-4-6-9(7)2/h3,7-8,10H,1,4-6H2,2H3
InChIKeyIVVNAGCHNGAKIN-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.63
Rot. Bonds1

About 2-ethenyl-1-methylpiperidin-3-ol

2-ethenyl-1-methylpiperidin-3-ol (PubChem CID 139998908) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 2-ethenyl-1-methylpiperidin-3-ol.

Molecular Properties

Compound Name2-ethenyl-1-methylpiperidin-3-ol
PubChem CID139998908
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name2-ethenyl-1-methylpiperidin-3-ol
SMILESC=CC1C(O)CCCN1C
InChIInChI=1S/C8H15NO/c1-3-7-8(10)5-4-6-9(7)2/h3,7-8,10H,1,4-6H2,2H3
InChIKeyIVVNAGCHNGAKIN-UHFFFAOYSA-N
XLogP0.63
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.63
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-(Piperidin-1-yl)but-3-en-1-ol
CID 226120
1-[(2S,3R)-2-ethenyl-3-hydroxypiperidin-1-yl]ethanone
CID 15415520
9-Azabicyclo[3.3.1]non-6-en-2-ol, 9-methyl-, endo-
CID 564941
1-[Di(propan-2-yl)amino]hex-5-en-2-ol
CID 22975448
1-Allyl-3-hydroxypiperidine
CID 58550019
1-But-3-enylpiperidin-3-ol
CID 64300040
Methane;1-prop-2-enylpiperidin-3-ol
CID 67493066
1-Piperidin-1-ylpent-4-en-2-ol
CID 70538589
1-Ethyl-5-methylidenepiperidin-3-ol
CID 89324075
(3S)-1-prop-2-enylpiperidin-3-ol
CID 107225869
2-Ethenylpiperidin-3-ol
CID 139998904
(2S,4R)-2-ethenyl-1-ethylpiperidin-4-ol
CID 146642329

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-1-methylpiperidin-3-ol?
The IUPAC name of 2-ethenyl-1-methylpiperidin-3-ol (CID 139998908) is 2-ethenyl-1-methylpiperidin-3-ol.
What is the SMILES notation for 2-ethenyl-1-methylpiperidin-3-ol?
The canonical SMILES for 2-ethenyl-1-methylpiperidin-3-ol is C=CC1C(O)CCCN1C.
What is the InChIKey of 2-ethenyl-1-methylpiperidin-3-ol?
The InChIKey is IVVNAGCHNGAKIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-3-7-8(10)5-4-6-9(7)2/h3,7-8,10H,1,4-6H2,2H3.
What are the key properties of 2-ethenyl-1-methylpiperidin-3-ol?
2-ethenyl-1-methylpiperidin-3-ol has a molecular weight of 141.21 g/mol, XLogP of 0.63, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-1-methylpiperidin-3-ol is sourced from PubChem (CID 139998908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).