5,6-di(ethylidene)-1-methylpiperidin-2-ol

C10H17NO — CID 123615765

IUPAC5,6-di(ethylidene)-1-methylpiperidin-2-ol
SMILESCC=C1CCC(O)N(C)C1=CC
InChIInChI=1S/C10H17NO/c1-4-8-6-7-10(12)11(3)9(8)5-2/h4-5,10,12H,6-7H2,1-3H3
InChIKeyODFIKFZAWCOTMR-UHFFFAOYSA-N
MW167.25 g/mol
LogP1.88
Rot. Bonds

About 5,6-di(ethylidene)-1-methylpiperidin-2-ol

5,6-di(ethylidene)-1-methylpiperidin-2-ol (PubChem CID 123615765) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 5,6-di(ethylidene)-1-methylpiperidin-2-ol.

Molecular Properties

Compound Name5,6-di(ethylidene)-1-methylpiperidin-2-ol
PubChem CID123615765
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name5,6-di(ethylidene)-1-methylpiperidin-2-ol
SMILESCC=C1CCC(O)N(C)C1=CC
InChIInChI=1S/C10H17NO/c1-4-8-6-7-10(12)11(3)9(8)5-2/h4-5,10,12H,6-7H2,1-3H3
InChIKeyODFIKFZAWCOTMR-UHFFFAOYSA-N
XLogP1.88
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-1-ethyl-5,6-dimethylidene-4-[(3Z)-penta-1,3-dien-2-yl]-3-propyl-2H-pyridin-2-ol
CID 118311785
5-(4-Pent-2-en-2-ylpiperazin-1-yl)pentan-1-ol
CID 124016774
2-[1-(4-Methylcyclohexa-1,3-dien-1-yl)piperidin-4-yl]ethanol
CID 143067090
5-[[(2E,4Z,6E)-8-(dimethylamino)-6,7-dimethylocta-2,4,6-trien-3-yl]-propylamino]pentan-1-ol
CID 143307643
(2E,3Z,5R)-2-ethylidene-5-(hydroxymethyl)-3-prop-2-enylidenepiperidine-1-sulfinate
CID 146174774
3-(1-pentyl-2H-pyridin-3-yl)propan-1-ol
CID 149737669
3-(1-pentyl-2H-pyridin-4-yl)propan-1-ol
CID 150285346
[1-[(3E,5Z)-5-methylhepta-1,3,5-trien-4-yl]piperidin-4-yl]methanol
CID 153547216
1-[(4E,6E)-2-methyldeca-2,4,6-trien-5-yl]piperidin-4-ol
CID 156421147
1-(4-Methylcyclohexa-2,4-dien-1-yl)piperidin-2-ol
CID 163423969
4-[1-[But-3-enyl(propyl)amino]ethenyl]cyclohexa-1,3-dien-1-ol
CID 163859776
1-(6-Methylcyclohexa-1,5-dien-1-yl)piperidin-4-ol
CID 173071099

Frequently Asked Questions

What is the IUPAC name of 5,6-di(ethylidene)-1-methylpiperidin-2-ol?
The IUPAC name of 5,6-di(ethylidene)-1-methylpiperidin-2-ol (CID 123615765) is 5,6-di(ethylidene)-1-methylpiperidin-2-ol.
What is the SMILES notation for 5,6-di(ethylidene)-1-methylpiperidin-2-ol?
The canonical SMILES for 5,6-di(ethylidene)-1-methylpiperidin-2-ol is CC=C1CCC(O)N(C)C1=CC.
What is the InChIKey of 5,6-di(ethylidene)-1-methylpiperidin-2-ol?
The InChIKey is ODFIKFZAWCOTMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-4-8-6-7-10(12)11(3)9(8)5-2/h4-5,10,12H,6-7H2,1-3H3.
What are the key properties of 5,6-di(ethylidene)-1-methylpiperidin-2-ol?
5,6-di(ethylidene)-1-methylpiperidin-2-ol has a molecular weight of 167.25 g/mol, XLogP of 1.88, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-di(ethylidene)-1-methylpiperidin-2-ol is sourced from PubChem (CID 123615765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).