[1-[(2Z)-2-ethenyl-3-fluoropenta-2,4-dienyl]-2,6-dimethylpiperidin-4-yl]methanol

C15H24FNO — CID 143623572

IUPAC[1-[(2Z)-2-ethenyl-3-fluoropenta-2,4-dienyl]-2,6-dimethylpiperidin-4-yl]methanol
SMILESC=C/C(F)=C(\C=C)CN1C(C)CC(CO)CC1C
InChIInChI=1S/C15H24FNO/c1-5-14(15(16)6-2)9-17-11(3)7-13(10-18)8-12(17)4/h5-6,11-13,18H,1-2,7-10H2,3-4H3/b15-14-
InChIKeyPOVJYJVWZCDXMF-PFONDFGASA-N
MW253.36 g/mol
LogP3.06
Rot. Bonds5

About [1-[(2Z)-2-ethenyl-3-fluoropenta-2,4-dienyl]-2,6-dimethylpiperidin-4-yl]methanol

[1-[(2Z)-2-ethenyl-3-fluoropenta-2,4-dienyl]-2,6-dimethylpiperidin-4-yl]methanol (PubChem CID 143623572) has the molecular formula C15H24FNO and a molecular weight of 253.36 g/mol. Its IUPAC name is [1-[(2Z)-2-ethenyl-3-fluoropenta-2,4-dienyl]-2,6-dimethylpiperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-[(2Z)-2-ethenyl-3-fluoropenta-2,4-dienyl]-2,6-dimethylpiperidin-4-yl]methanol
PubChem CID143623572
Molecular FormulaC15H24FNO
Molecular Weight253.36 g/mol
Exact Mass253.18
IUPAC Name[1-[(2Z)-2-ethenyl-3-fluoropenta-2,4-dienyl]-2,6-dimethylpiperidin-4-yl]methanol
SMILESC=C/C(F)=C(\C=C)CN1C(C)CC(CO)CC1C
InChIInChI=1S/C15H24FNO/c1-5-14(15(16)6-2)9-17-11(3)7-13(10-18)8-12(17)4/h5-6,11-13,18H,1-2,7-10H2,3-4H3/b15-14-
InChIKeyPOVJYJVWZCDXMF-PFONDFGASA-N
XLogP3.06
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.36
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

2-[3,5-Dimethyl-1-(2-methylidenepent-3-enyl)piperidin-2-yl]ethanol
CID 123183755
2-[3,5-dimethyl-1-[(Z)-2-methylidenepent-3-enyl]piperidin-2-yl]ethanol
CID 173535528
[(2R,4R)-1-[(2E)-2-ethenylpenta-2,4-dienyl]-2-methylpiperidin-4-yl]methanol;methanol
CID 176706083
2-(1-But-3-en-2-ylpiperidin-3-yl)ethanol
CID 62383456
[(2R,4R)-1-[(2E)-2-ethenylpenta-2,4-dienyl]-2-methylpiperidin-4-yl]methanol
CID 176706084

Frequently Asked Questions

What is the IUPAC name of [1-[(2Z)-2-ethenyl-3-fluoropenta-2,4-dienyl]-2,6-dimethylpiperidin-4-yl]methanol?
The IUPAC name of [1-[(2Z)-2-ethenyl-3-fluoropenta-2,4-dienyl]-2,6-dimethylpiperidin-4-yl]methanol (CID 143623572) is [1-[(2Z)-2-ethenyl-3-fluoropenta-2,4-dienyl]-2,6-dimethylpiperidin-4-yl]methanol.
What is the SMILES notation for [1-[(2Z)-2-ethenyl-3-fluoropenta-2,4-dienyl]-2,6-dimethylpiperidin-4-yl]methanol?
The canonical SMILES for [1-[(2Z)-2-ethenyl-3-fluoropenta-2,4-dienyl]-2,6-dimethylpiperidin-4-yl]methanol is C=C/C(F)=C(\C=C)CN1C(C)CC(CO)CC1C.
What is the InChIKey of [1-[(2Z)-2-ethenyl-3-fluoropenta-2,4-dienyl]-2,6-dimethylpiperidin-4-yl]methanol?
The InChIKey is POVJYJVWZCDXMF-PFONDFGASA-N. The full InChI is InChI=1S/C15H24FNO/c1-5-14(15(16)6-2)9-17-11(3)7-13(10-18)8-12(17)4/h5-6,11-13,18H,1-2,7-10H2,3-4H3/b15-14-.
What are the key properties of [1-[(2Z)-2-ethenyl-3-fluoropenta-2,4-dienyl]-2,6-dimethylpiperidin-4-yl]methanol?
[1-[(2Z)-2-ethenyl-3-fluoropenta-2,4-dienyl]-2,6-dimethylpiperidin-4-yl]methanol has a molecular weight of 253.36 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(2Z)-2-ethenyl-3-fluoropenta-2,4-dienyl]-2,6-dimethylpiperidin-4-yl]methanol is sourced from PubChem (CID 143623572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).