morpholin-4-yl-[1-(1-phenylcyclobutanecarbonyl)piperidin-3-yl]methanone

C21H28N2O3 — CID 56807476

IUPACmorpholin-4-yl-[1-(1-phenylcyclobutanecarbonyl)piperidin-3-yl]methanone
SMILESO=C(C1CCCN(C(=O)C2(c3ccccc3)CCC2)C1)N1CCOCC1
InChIInChI=1S/C21H28N2O3/c24-19(22-12-14-26-15-13-22)17-6-4-11-23(16-17)20(25)21(9-5-10-21)18-7-2-1-3-8-18/h1-3,7-8,17H,4-6,9-16H2
InChIKeyMOJDISAMQXKCEM-UHFFFAOYSA-N
MW356.47 g/mol
LogP2.21
Rot. Bonds3

About morpholin-4-yl-[1-(1-phenylcyclobutanecarbonyl)piperidin-3-yl]methanone

morpholin-4-yl-[1-(1-phenylcyclobutanecarbonyl)piperidin-3-yl]methanone (PubChem CID 56807476) has the molecular formula C21H28N2O3 and a molecular weight of 356.47 g/mol. Its IUPAC name is morpholin-4-yl-[1-(1-phenylcyclobutanecarbonyl)piperidin-3-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[1-(1-phenylcyclobutanecarbonyl)piperidin-3-yl]methanone
PubChem CID56807476
Molecular FormulaC21H28N2O3
Molecular Weight356.47 g/mol
Exact Mass356.21
IUPAC Namemorpholin-4-yl-[1-(1-phenylcyclobutanecarbonyl)piperidin-3-yl]methanone
SMILESO=C(C1CCCN(C(=O)C2(c3ccccc3)CCC2)C1)N1CCOCC1
InChIInChI=1S/C21H28N2O3/c24-19(22-12-14-26-15-13-22)17-6-4-11-23(16-17)20(25)21(9-5-10-21)18-7-2-1-3-8-18/h1-3,7-8,17H,4-6,9-16H2
InChIKeyMOJDISAMQXKCEM-UHFFFAOYSA-N
XLogP2.21
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.47
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(1-phenylcyclopropanecarbonyl)piperidin-3-yl]-pyrrolidin-1-ylmethanone
CID 71876645
1-(4-phenyloxane-4-carbonyl)piperidine-3-carboxylic acid
CID 119128018
cyclobutyl-[4-(1-phenylcyclopropanecarbonyl)piperazin-1-yl]methanone
CID 75369417
[1-[1-(4-chlorophenyl)cyclobutanecarbonyl]piperidin-4-yl]-morpholin-4-ylmethanone
CID 78778814
1-[4-(4-bromophenyl)oxane-4-carbonyl]piperidine-3-carboxylic acid
CID 119128019
[6-(hydroxymethyl)-1,4-oxazepan-4-yl]-(1-phenylcyclohexyl)methanone
CID 70723981
1-[1-(4-bromophenyl)cyclobutanecarbonyl]piperidine-3-carboxylic acid
CID 119167254
cyclohexyl-[4-phenyl-4-(4-phenylpiperazine-1-carbonyl)piperidin-1-yl]methanone
CID 22241011
1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-2-phenylsulfanylethanone
CID 75838690
[2-(hydroxymethyl)morpholin-4-yl]-(1-phenylcyclopentyl)methanone
CID 81196589
2-amino-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-2-phenylethanone;hydrochloride
CID 119277072
1-[1-(4-methylphenyl)cyclobutanecarbonyl]-N-phenylpiperidine-3-carboxamide
CID 142125162

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[1-(1-phenylcyclobutanecarbonyl)piperidin-3-yl]methanone?
The IUPAC name of morpholin-4-yl-[1-(1-phenylcyclobutanecarbonyl)piperidin-3-yl]methanone (CID 56807476) is morpholin-4-yl-[1-(1-phenylcyclobutanecarbonyl)piperidin-3-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[1-(1-phenylcyclobutanecarbonyl)piperidin-3-yl]methanone?
The canonical SMILES for morpholin-4-yl-[1-(1-phenylcyclobutanecarbonyl)piperidin-3-yl]methanone is O=C(C1CCCN(C(=O)C2(c3ccccc3)CCC2)C1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-[1-(1-phenylcyclobutanecarbonyl)piperidin-3-yl]methanone?
The InChIKey is MOJDISAMQXKCEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N2O3/c24-19(22-12-14-26-15-13-22)17-6-4-11-23(16-17)20(25)21(9-5-10-21)18-7-2-1-3-8-18/h1-3,7-8,17H,4-6,9-16H2.
What are the key properties of morpholin-4-yl-[1-(1-phenylcyclobutanecarbonyl)piperidin-3-yl]methanone?
morpholin-4-yl-[1-(1-phenylcyclobutanecarbonyl)piperidin-3-yl]methanone has a molecular weight of 356.47 g/mol, XLogP of 2.21, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[1-(1-phenylcyclobutanecarbonyl)piperidin-3-yl]methanone is sourced from PubChem (CID 56807476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).