1-(4-hydroxypiperidin-1-yl)dec-2-en-1-one

C15H27NO2 — CID 123727721

IUPAC1-(4-hydroxypiperidin-1-yl)dec-2-en-1-one
SMILESCCCCCCCC=CC(=O)N1CCC(O)CC1
InChIInChI=1S/C15H27NO2/c1-2-3-4-5-6-7-8-9-15(18)16-12-10-14(17)11-13-16/h8-9,14,17H,2-7,10-13H2,1H3
InChIKeyNSMOMEOZRWGHMP-UHFFFAOYSA-N
MW253.39 g/mol
LogP2.89
Rot. Bonds7

About 1-(4-hydroxypiperidin-1-yl)dec-2-en-1-one

1-(4-hydroxypiperidin-1-yl)dec-2-en-1-one (PubChem CID 123727721) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is 1-(4-hydroxypiperidin-1-yl)dec-2-en-1-one.

Molecular Properties

Compound Name1-(4-hydroxypiperidin-1-yl)dec-2-en-1-one
PubChem CID123727721
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC Name1-(4-hydroxypiperidin-1-yl)dec-2-en-1-one
SMILESCCCCCCCC=CC(=O)N1CCC(O)CC1
InChIInChI=1S/C15H27NO2/c1-2-3-4-5-6-7-8-9-15(18)16-12-10-14(17)11-13-16/h8-9,14,17H,2-7,10-13H2,1H3
InChIKeyNSMOMEOZRWGHMP-UHFFFAOYSA-N
XLogP2.89
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

(E)-1-(azepan-1-yl)dec-2-en-1-one
CID 46935133
1-(azepan-1-yl)dec-2-en-1-one
CID 66769739
(E)-1-piperidin-1-yltridec-2-en-1-one
CID 102388697
1-(1,3-thiazolidin-3-yl)dec-2-en-1-one
CID 123835401
1-pyrrolidin-1-ylicosa-2,4,14-trien-1-one
CID 76515599
(2E,4E,12Z)-1-pyrrolidin-1-yloctadeca-2,4,12-trien-1-one
CID 57338317
4-[(4-dec-2-enoylpiperazin-1-yl)methyl]benzoic acid
CID 123726468
(Z)-non-2-enamide
CID 97047009
methyl (2S)-1-dec-2-enoylpyrrolidine-2-carboxylate
CID 123723615
S-cyclopentyl dec-2-enethioate
CID 76513085
docosa-2,13-dienamide
CID 91597038
undec-2-enoic acid
CID 519180

Frequently Asked Questions

What is the IUPAC name of 1-(4-hydroxypiperidin-1-yl)dec-2-en-1-one?
The IUPAC name of 1-(4-hydroxypiperidin-1-yl)dec-2-en-1-one (CID 123727721) is 1-(4-hydroxypiperidin-1-yl)dec-2-en-1-one.
What is the SMILES notation for 1-(4-hydroxypiperidin-1-yl)dec-2-en-1-one?
The canonical SMILES for 1-(4-hydroxypiperidin-1-yl)dec-2-en-1-one is CCCCCCCC=CC(=O)N1CCC(O)CC1.
What is the InChIKey of 1-(4-hydroxypiperidin-1-yl)dec-2-en-1-one?
The InChIKey is NSMOMEOZRWGHMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2/c1-2-3-4-5-6-7-8-9-15(18)16-12-10-14(17)11-13-16/h8-9,14,17H,2-7,10-13H2,1H3.
What are the key properties of 1-(4-hydroxypiperidin-1-yl)dec-2-en-1-one?
1-(4-hydroxypiperidin-1-yl)dec-2-en-1-one has a molecular weight of 253.39 g/mol, XLogP of 2.89, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxypiperidin-1-yl)dec-2-en-1-one is sourced from PubChem (CID 123727721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).