4-[4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzoyl]piperazin-2-one

C20H25N3O4 — CID 72845459

IUPAC4-[4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzoyl]piperazin-2-one
SMILESO=C1CN(C(=O)c2ccc(OC3CCN(C(=O)C4CC4)CC3)cc2)CCN1
InChIInChI=1S/C20H25N3O4/c24-18-13-23(12-9-21-18)20(26)15-3-5-16(6-4-15)27-17-7-10-22(11-8-17)19(25)14-1-2-14/h3-6,14,17H,1-2,7-13H2,(H,21,24)
InChIKeyAYFBRJNPONAQLT-UHFFFAOYSA-N
MW371.44 g/mol
LogP1.04
Rot. Bonds4

About 4-[4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzoyl]piperazin-2-one

4-[4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzoyl]piperazin-2-one (PubChem CID 72845459) has the molecular formula C20H25N3O4 and a molecular weight of 371.44 g/mol. Its IUPAC name is 4-[4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzoyl]piperazin-2-one.

Molecular Properties

Compound Name4-[4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzoyl]piperazin-2-one
PubChem CID72845459
Molecular FormulaC20H25N3O4
Molecular Weight371.44 g/mol
Exact Mass371.18
IUPAC Name4-[4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzoyl]piperazin-2-one
SMILESO=C1CN(C(=O)c2ccc(OC3CCN(C(=O)C4CC4)CC3)cc2)CCN1
InChIInChI=1S/C20H25N3O4/c24-18-13-23(12-9-21-18)20(26)15-3-5-16(6-4-15)27-17-7-10-22(11-8-17)19(25)14-1-2-14/h3-6,14,17H,1-2,7-13H2,(H,21,24)
InChIKeyAYFBRJNPONAQLT-UHFFFAOYSA-N
XLogP1.04
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

cyclopropyl-[4-[4-[(3R)-3-(4-fluorophenyl)pyrrolidine-1-carbonyl]phenoxy]piperidin-1-yl]methanone
CID 42116086
cyclopropyl-[4-[4-[(2S)-2-methylpiperidine-1-carbonyl]phenoxy]piperidin-1-yl]methanone
CID 42466727
4-(4-aminobenzoyl)piperazin-2-one;hydrochloride
CID 119681651
cyclopropyl-[4-(4-methoxyphenoxy)piperidin-1-yl]methanone
CID 110396800
cyclopropyl-[4-[4-(4-pyridin-2-ylpiperazine-1-carbonyl)phenoxy]piperidin-1-yl]methanone
CID 42194632
4-(4-sulfanylbenzoyl)piperazin-2-one
CID 107021530
cyclopropyl-[4-[4-[(2R)-2-(methoxymethyl)piperidine-1-carbonyl]phenoxy]piperidin-1-yl]methanone
CID 26398196
[4-(4-methoxyphenoxy)piperidin-1-yl]-(4-methoxyphenyl)methanone
CID 110396821
4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-ethylbenzamide
CID 42153100
cyclopropyl-[4-[4-[(2R)-2-propan-2-yl-2,5-dihydropyrrole-1-carbonyl]phenoxy]piperidin-1-yl]methanone
CID 97271242
cyclopropyl-[4-[4-(2-propan-2-yl-2,5-dihydropyrrole-1-carbonyl)phenoxy]piperidin-1-yl]methanone
CID 72854891
(3S)-4-[4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzoyl]-1-ethyl-3-methylpiperazin-2-one
CID 26407564

Frequently Asked Questions

What is the IUPAC name of 4-[4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzoyl]piperazin-2-one?
The IUPAC name of 4-[4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzoyl]piperazin-2-one (CID 72845459) is 4-[4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzoyl]piperazin-2-one.
What is the SMILES notation for 4-[4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzoyl]piperazin-2-one?
The canonical SMILES for 4-[4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzoyl]piperazin-2-one is O=C1CN(C(=O)c2ccc(OC3CCN(C(=O)C4CC4)CC3)cc2)CCN1.
What is the InChIKey of 4-[4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzoyl]piperazin-2-one?
The InChIKey is AYFBRJNPONAQLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O4/c24-18-13-23(12-9-21-18)20(26)15-3-5-16(6-4-15)27-17-7-10-22(11-8-17)19(25)14-1-2-14/h3-6,14,17H,1-2,7-13H2,(H,21,24).
What are the key properties of 4-[4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzoyl]piperazin-2-one?
4-[4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzoyl]piperazin-2-one has a molecular weight of 371.44 g/mol, XLogP of 1.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzoyl]piperazin-2-one is sourced from PubChem (CID 72845459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).