2-(2-methylprop-2-enyl)piperidin-3-ol

C9H17NO — CID 86229520

IUPAC2-(2-methylprop-2-enyl)piperidin-3-ol
SMILESC=C(C)CC1NCCCC1O
InChIInChI=1S/C9H17NO/c1-7(2)6-8-9(11)4-3-5-10-8/h8-11H,1,3-6H2,2H3
InChIKeySSVAQOYRHYAHDB-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.07
Rot. Bonds2

About 2-(2-methylprop-2-enyl)piperidin-3-ol

2-(2-methylprop-2-enyl)piperidin-3-ol (PubChem CID 86229520) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 2-(2-methylprop-2-enyl)piperidin-3-ol.

Molecular Properties

Compound Name2-(2-methylprop-2-enyl)piperidin-3-ol
PubChem CID86229520
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name2-(2-methylprop-2-enyl)piperidin-3-ol
SMILESC=C(C)CC1NCCCC1O
InChIInChI=1S/C9H17NO/c1-7(2)6-8-9(11)4-3-5-10-8/h8-11H,1,3-6H2,2H3
InChIKeySSVAQOYRHYAHDB-UHFFFAOYSA-N
XLogP1.07
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.07
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

cis-3-Hydroxy-2-propylpiperidine
CID 567632
(2R,3S)-2-prop-2-enylpiperidin-3-ol
CID 55287222
(4-Methylidenepiperidin-2-yl)methanol
CID 66733503
6-Prop-2-enylpiperidin-3-ol
CID 67413271
1-Piperidin-2-ylbut-3-en-1-ol
CID 70541220
2-Prop-2-enylpiperidin-3-ol
CID 76224088
4-(Dimethylaminomethylidene)-2-methylpiperidin-3-ol
CID 90902595
6-(Cyclopropen-1-ylmethyl)piperidin-3-ol
CID 91348641
(2S,3R)-2-prop-2-enylpiperidin-3-ol
CID 141512712
2-[(3Z)-2-methylidenehexa-3,5-dienyl]piperidin-3-ol
CID 156749674
4-Methylidene-2-prop-2-enylpiperidin-3-ol
CID 163929424
(2S,3S)-2-(2-chloroprop-2-enyl)-6-propylpiperidin-3-ol
CID 166812063

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylprop-2-enyl)piperidin-3-ol?
The IUPAC name of 2-(2-methylprop-2-enyl)piperidin-3-ol (CID 86229520) is 2-(2-methylprop-2-enyl)piperidin-3-ol.
What is the SMILES notation for 2-(2-methylprop-2-enyl)piperidin-3-ol?
The canonical SMILES for 2-(2-methylprop-2-enyl)piperidin-3-ol is C=C(C)CC1NCCCC1O.
What is the InChIKey of 2-(2-methylprop-2-enyl)piperidin-3-ol?
The InChIKey is SSVAQOYRHYAHDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-7(2)6-8-9(11)4-3-5-10-8/h8-11H,1,3-6H2,2H3.
What are the key properties of 2-(2-methylprop-2-enyl)piperidin-3-ol?
2-(2-methylprop-2-enyl)piperidin-3-ol has a molecular weight of 155.24 g/mol, XLogP of 1.07, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylprop-2-enyl)piperidin-3-ol is sourced from PubChem (CID 86229520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).