morpholin-4-yl-[4-(3-piperidin-1-ylazetidine-1-carbonyl)phenyl]methanone

C20H27N3O3 — CID 91828611

IUPACmorpholin-4-yl-[4-(3-piperidin-1-ylazetidine-1-carbonyl)phenyl]methanone
SMILESO=C(c1ccc(C(=O)N2CC(N3CCCCC3)C2)cc1)N1CCOCC1
InChIInChI=1S/C20H27N3O3/c24-19(22-10-12-26-13-11-22)16-4-6-17(7-5-16)20(25)23-14-18(15-23)21-8-2-1-3-9-21/h4-7,18H,1-3,8-15H2
InChIKeyFBWRYHIMLDOAPA-UHFFFAOYSA-N
MW357.45 g/mol
LogP1.47
Rot. Bonds3

About morpholin-4-yl-[4-(3-piperidin-1-ylazetidine-1-carbonyl)phenyl]methanone

morpholin-4-yl-[4-(3-piperidin-1-ylazetidine-1-carbonyl)phenyl]methanone (PubChem CID 91828611) has the molecular formula C20H27N3O3 and a molecular weight of 357.45 g/mol. Its IUPAC name is morpholin-4-yl-[4-(3-piperidin-1-ylazetidine-1-carbonyl)phenyl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[4-(3-piperidin-1-ylazetidine-1-carbonyl)phenyl]methanone
PubChem CID91828611
Molecular FormulaC20H27N3O3
Molecular Weight357.45 g/mol
Exact Mass357.21
IUPAC Namemorpholin-4-yl-[4-(3-piperidin-1-ylazetidine-1-carbonyl)phenyl]methanone
SMILESO=C(c1ccc(C(=O)N2CC(N3CCCCC3)C2)cc1)N1CCOCC1
InChIInChI=1S/C20H27N3O3/c24-19(22-10-12-26-13-11-22)16-4-6-17(7-5-16)20(25)23-14-18(15-23)21-8-2-1-3-9-21/h4-7,18H,1-3,8-15H2
InChIKeyFBWRYHIMLDOAPA-UHFFFAOYSA-N
XLogP1.47
TPSA53.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.45
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[4-[1-(4-morpholin-4-ylbenzoyl)azetidin-3-yl]piperazin-1-yl]-phenylmethanone
CID 66840390
[4-(4-piperidin-1-ylpiperidine-1-carbonyl)phenyl]-(4-piperidin-1-ylpiperidin-1-yl)methanone
CID 70679311
[4-(4-methylsulfanylphenyl)phenyl]-(3-piperidin-1-ylazetidin-1-yl)methanone
CID 119071128
(4-methylphenyl)-(3-morpholin-4-ylpiperidin-1-yl)methanone
CID 121451758
[4-(hydroxymethyl)phenyl]-morpholin-4-ylmethanone
CID 60635795
[4-(azocane-1-carbonyl)phenyl]-(azocan-1-yl)methanone
CID 3317192
(4-aminophenyl)-(4-morpholin-4-ylpiperidin-1-yl)methanone
CID 158649732
(4-iodophenyl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone
CID 63524427
lithium 4-(morpholine-4-carbonyl)benzoate
CID 142428468
(4-fluorophenyl)-(1,4-oxazepan-4-yl)methanone
CID 62060048
(4-aminophenyl)-(4-piperidin-1-ylpiperidin-1-yl)methanone;dihydrochloride
CID 119842939
[1-(4-aminobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone
CID 119700503

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[4-(3-piperidin-1-ylazetidine-1-carbonyl)phenyl]methanone?
The IUPAC name of morpholin-4-yl-[4-(3-piperidin-1-ylazetidine-1-carbonyl)phenyl]methanone (CID 91828611) is morpholin-4-yl-[4-(3-piperidin-1-ylazetidine-1-carbonyl)phenyl]methanone.
What is the SMILES notation for morpholin-4-yl-[4-(3-piperidin-1-ylazetidine-1-carbonyl)phenyl]methanone?
The canonical SMILES for morpholin-4-yl-[4-(3-piperidin-1-ylazetidine-1-carbonyl)phenyl]methanone is O=C(c1ccc(C(=O)N2CC(N3CCCCC3)C2)cc1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-[4-(3-piperidin-1-ylazetidine-1-carbonyl)phenyl]methanone?
The InChIKey is FBWRYHIMLDOAPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O3/c24-19(22-10-12-26-13-11-22)16-4-6-17(7-5-16)20(25)23-14-18(15-23)21-8-2-1-3-9-21/h4-7,18H,1-3,8-15H2.
What are the key properties of morpholin-4-yl-[4-(3-piperidin-1-ylazetidine-1-carbonyl)phenyl]methanone?
morpholin-4-yl-[4-(3-piperidin-1-ylazetidine-1-carbonyl)phenyl]methanone has a molecular weight of 357.45 g/mol, XLogP of 1.47, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[4-(3-piperidin-1-ylazetidine-1-carbonyl)phenyl]methanone is sourced from PubChem (CID 91828611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).