[(3R)-1-decylpiperidin-3-yl]-morpholin-4-ylmethanone

C20H38N2O2 — CID 125473797

IUPAC[(3R)-1-decylpiperidin-3-yl]-morpholin-4-ylmethanone
SMILESCCCCCCCCCCN1CCC[C@@H](C(=O)N2CCOCC2)C1
InChIInChI=1S/C20H38N2O2/c1-2-3-4-5-6-7-8-9-12-21-13-10-11-19(18-21)20(23)22-14-16-24-17-15-22/h19H,2-18H2,1H3/t19-/m1/s1
InChIKeyZAQYRMAUYZEQCO-LJQANCHMSA-N
MW338.54 g/mol
LogP3.70
Rot. Bonds10

About [(3R)-1-decylpiperidin-3-yl]-morpholin-4-ylmethanone

[(3R)-1-decylpiperidin-3-yl]-morpholin-4-ylmethanone (PubChem CID 125473797) has the molecular formula C20H38N2O2 and a molecular weight of 338.54 g/mol. Its IUPAC name is [(3R)-1-decylpiperidin-3-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[(3R)-1-decylpiperidin-3-yl]-morpholin-4-ylmethanone
PubChem CID125473797
Molecular FormulaC20H38N2O2
Molecular Weight338.54 g/mol
Exact Mass338.29
IUPAC Name[(3R)-1-decylpiperidin-3-yl]-morpholin-4-ylmethanone
SMILESCCCCCCCCCCN1CCC[C@@H](C(=O)N2CCOCC2)C1
InChIInChI=1S/C20H38N2O2/c1-2-3-4-5-6-7-8-9-12-21-13-10-11-19(18-21)20(23)22-14-16-24-17-15-22/h19H,2-18H2,1H3/t19-/m1/s1
InChIKeyZAQYRMAUYZEQCO-LJQANCHMSA-N
XLogP3.70
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.54
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

methyl (3S)-1-decylpiperidine-3-carboxylate
CID 115537543
(3S)-1-dodecylpiperidine-3-carboxamide
CID 98141559
[(3R)-1-methylpiperidin-3-yl]-morpholin-4-ylmethanone
CID 95907299
morpholin-4-yl-[(3S)-1-(3-pyridin-4-ylpropyl)piperidin-3-yl]methanone
CID 97352804
[(3S)-1-[(3,5-dimethyl-1-propylpyrazol-4-yl)methyl]piperidin-3-yl]-morpholin-4-ylmethanone
CID 97332169
1-(4-methylpiperidin-1-yl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]ethanone
CID 134051301
cyclobutyl-(4-pentylpiperazin-1-yl)methanone
CID 113075121
ethyl (3S)-1-hexylpiperidine-3-carboxylate
CID 81337885
N-(2-methylbutan-2-yl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide
CID 134051259
ethyl 1-dodecylpiperidine-3-carboxylate;hydrochloride
CID 117069127
1-decyl-N-ethyl-N-methylpiperidine-3-carboxamide
CID 90679730
morpholin-4-yl-[1-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-3-yl]methanone
CID 56706828

Frequently Asked Questions

What is the IUPAC name of [(3R)-1-decylpiperidin-3-yl]-morpholin-4-ylmethanone?
The IUPAC name of [(3R)-1-decylpiperidin-3-yl]-morpholin-4-ylmethanone (CID 125473797) is [(3R)-1-decylpiperidin-3-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [(3R)-1-decylpiperidin-3-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [(3R)-1-decylpiperidin-3-yl]-morpholin-4-ylmethanone is CCCCCCCCCCN1CCC[C@@H](C(=O)N2CCOCC2)C1.
What is the InChIKey of [(3R)-1-decylpiperidin-3-yl]-morpholin-4-ylmethanone?
The InChIKey is ZAQYRMAUYZEQCO-LJQANCHMSA-N. The full InChI is InChI=1S/C20H38N2O2/c1-2-3-4-5-6-7-8-9-12-21-13-10-11-19(18-21)20(23)22-14-16-24-17-15-22/h19H,2-18H2,1H3/t19-/m1/s1.
What are the key properties of [(3R)-1-decylpiperidin-3-yl]-morpholin-4-ylmethanone?
[(3R)-1-decylpiperidin-3-yl]-morpholin-4-ylmethanone has a molecular weight of 338.54 g/mol, XLogP of 3.70, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-1-decylpiperidin-3-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 125473797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).