(Z)-3-(1-methylpiperidin-2-yl)prop-2-en-1-ol

C9H17NO — CID 117266014

IUPAC(Z)-3-(1-methylpiperidin-2-yl)prop-2-en-1-ol
SMILESCN1CCCCC1/C=C\CO
InChIInChI=1S/C9H17NO/c1-10-7-3-2-5-9(10)6-4-8-11/h4,6,9,11H,2-3,5,7-8H2,1H3/b6-4-
InChIKeyJQVNDHNGIUZHFF-XQRVVYSFSA-N
MW155.24 g/mol
LogP1.02
Rot. Bonds2

About (Z)-3-(1-methylpiperidin-2-yl)prop-2-en-1-ol

(Z)-3-(1-methylpiperidin-2-yl)prop-2-en-1-ol (PubChem CID 117266014) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is (Z)-3-(1-methylpiperidin-2-yl)prop-2-en-1-ol.

Molecular Properties

Compound Name(Z)-3-(1-methylpiperidin-2-yl)prop-2-en-1-ol
PubChem CID117266014
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name(Z)-3-(1-methylpiperidin-2-yl)prop-2-en-1-ol
SMILESCN1CCCCC1/C=C\CO
InChIInChI=1S/C9H17NO/c1-10-7-3-2-5-9(10)6-4-8-11/h4,6,9,11H,2-3,5,7-8H2,1H3/b6-4-
InChIKeyJQVNDHNGIUZHFF-XQRVVYSFSA-N
XLogP1.02
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.02
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

[(1Z,6Z)-2-fluoro-5-piperidin-1-ylcycloocta-1,6-dien-1-yl]methanol
CID 144045839
4-(Piperidin-1-yl)cyclohex-2-en-1-ol
CID 71385044
(E)-3-[(2R)-1-methylpyrrolidin-2-yl]prop-2-en-1-ol
CID 15480743
2-(1-Butylpiperidin-4-ylidene)ethanol
CID 18695481
(R)-3-Hydroxy-1-(N-methylpyrrolidin-2-yl)propene
CID 53698862
(1-Butyl-2-ethenylpiperidin-1-ium-1-yl)methanol
CID 57036753
(2-Ethenyl-1-propan-2-ylpiperidin-1-ium-1-yl)methanol
CID 57190674
(1R,4S)-4-piperidin-1-ylcyclopent-2-en-1-ol
CID 59511787
1-Piperidin-1-ylbut-2-en-1-ol
CID 69342629
3-(1-Methylpyrrolidin-2-yl)prop-2-en-1-ol
CID 70146895
(2E)-1-[cyclohexyl(methyl)amino]-3,7-dimethylocta-2,6-dien-1-ol
CID 70435113
1-(2-Prop-2-enylpiperidin-1-yl)prop-2-en-1-ol
CID 70599889

Frequently Asked Questions

What is the IUPAC name of (Z)-3-(1-methylpiperidin-2-yl)prop-2-en-1-ol?
The IUPAC name of (Z)-3-(1-methylpiperidin-2-yl)prop-2-en-1-ol (CID 117266014) is (Z)-3-(1-methylpiperidin-2-yl)prop-2-en-1-ol.
What is the SMILES notation for (Z)-3-(1-methylpiperidin-2-yl)prop-2-en-1-ol?
The canonical SMILES for (Z)-3-(1-methylpiperidin-2-yl)prop-2-en-1-ol is CN1CCCCC1/C=C\CO.
What is the InChIKey of (Z)-3-(1-methylpiperidin-2-yl)prop-2-en-1-ol?
The InChIKey is JQVNDHNGIUZHFF-XQRVVYSFSA-N. The full InChI is InChI=1S/C9H17NO/c1-10-7-3-2-5-9(10)6-4-8-11/h4,6,9,11H,2-3,5,7-8H2,1H3/b6-4-.
What are the key properties of (Z)-3-(1-methylpiperidin-2-yl)prop-2-en-1-ol?
(Z)-3-(1-methylpiperidin-2-yl)prop-2-en-1-ol has a molecular weight of 155.24 g/mol, XLogP of 1.02, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-(1-methylpiperidin-2-yl)prop-2-en-1-ol is sourced from PubChem (CID 117266014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).