[1-(2-methylidenebutyl)piperidin-2-yl]methanol

C11H21NO — CID 66038063

IUPAC[1-(2-methylidenebutyl)piperidin-2-yl]methanol
SMILESC=C(CC)CN1CCCCC1CO
InChIInChI=1S/C11H21NO/c1-3-10(2)8-12-7-5-4-6-11(12)9-13/h11,13H,2-9H2,1H3
InChIKeyOFHQUQBRNRYZNN-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.80
Rot. Bonds4

About [1-(2-methylidenebutyl)piperidin-2-yl]methanol

[1-(2-methylidenebutyl)piperidin-2-yl]methanol (PubChem CID 66038063) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is [1-(2-methylidenebutyl)piperidin-2-yl]methanol.

Molecular Properties

Compound Name[1-(2-methylidenebutyl)piperidin-2-yl]methanol
PubChem CID66038063
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name[1-(2-methylidenebutyl)piperidin-2-yl]methanol
SMILESC=C(CC)CN1CCCCC1CO
InChIInChI=1S/C11H21NO/c1-3-10(2)8-12-7-5-4-6-11(12)9-13/h11,13H,2-9H2,1H3
InChIKeyOFHQUQBRNRYZNN-UHFFFAOYSA-N
XLogP1.80
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.80
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

(1-Prop-2-enylpiperidin-2-yl)methanol
CID 58550098
1-(1-Methylpiperidin-2-yl)ethenol
CID 76831448
[(5E)-1-ethyl-4-methylidene-5-prop-2-enylidenepiperidin-2-yl]methanol
CID 143866514
ethane;[1-[(Z)-2-methylidenepent-3-enyl]piperidin-2-yl]methanol
CID 144575297
Ethane;(1-prop-1-en-2-ylpiperidin-2-yl)methanol
CID 163219762
1-[(2S)-1-tert-butylpiperidin-2-yl]ethenol
CID 170290439
Potassium;carbanide;ethane;(1-methyl-5-methylidenepiperidin-2-yl)methanolate
CID 176568266
Ethane;2-(methoxymethyl)-1-methyl-5-methylidenepiperidine
CID 176568280
2-(Methoxymethyl)-1-methyl-5-methylidenepiperidine
CID 176568281
Cadmium;methanol;1-methyl-5-methylidene-2-(propan-2-yloxymethyl)piperidine
CID 176568430
2-(Ethoxymethyl)-1-methyl-5-methylidenepiperidine
CID 176568671
1-Methyl-5-methylidene-2-(propoxymethyl)piperidine
CID 176927872

Frequently Asked Questions

What is the IUPAC name of [1-(2-methylidenebutyl)piperidin-2-yl]methanol?
The IUPAC name of [1-(2-methylidenebutyl)piperidin-2-yl]methanol (CID 66038063) is [1-(2-methylidenebutyl)piperidin-2-yl]methanol.
What is the SMILES notation for [1-(2-methylidenebutyl)piperidin-2-yl]methanol?
The canonical SMILES for [1-(2-methylidenebutyl)piperidin-2-yl]methanol is C=C(CC)CN1CCCCC1CO.
What is the InChIKey of [1-(2-methylidenebutyl)piperidin-2-yl]methanol?
The InChIKey is OFHQUQBRNRYZNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-3-10(2)8-12-7-5-4-6-11(12)9-13/h11,13H,2-9H2,1H3.
What are the key properties of [1-(2-methylidenebutyl)piperidin-2-yl]methanol?
[1-(2-methylidenebutyl)piperidin-2-yl]methanol has a molecular weight of 183.29 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methylidenebutyl)piperidin-2-yl]methanol is sourced from PubChem (CID 66038063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).