6-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]piperazin-2-one

C17H23N3O4 — CID 70743927

IUPAC6-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]piperazin-2-one
SMILESCOc1ccccc1OC1CCN(C(=O)C2CNCC(=O)N2)CC1
InChIInChI=1S/C17H23N3O4/c1-23-14-4-2-3-5-15(14)24-12-6-8-20(9-7-12)17(22)13-10-18-11-16(21)19-13/h2-5,12-13,18H,6-11H2,1H3,(H,19,21)
InChIKeyFKSMRQLYNMJWKB-UHFFFAOYSA-N
MW333.39 g/mol
LogP0.15
Rot. Bonds4

About 6-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]piperazin-2-one

6-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]piperazin-2-one (PubChem CID 70743927) has the molecular formula C17H23N3O4 and a molecular weight of 333.39 g/mol. Its IUPAC name is 6-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]piperazin-2-one.

Molecular Properties

Compound Name6-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]piperazin-2-one
PubChem CID70743927
Molecular FormulaC17H23N3O4
Molecular Weight333.39 g/mol
Exact Mass333.17
IUPAC Name6-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]piperazin-2-one
SMILESCOc1ccccc1OC1CCN(C(=O)C2CNCC(=O)N2)CC1
InChIInChI=1S/C17H23N3O4/c1-23-14-4-2-3-5-15(14)24-12-6-8-20(9-7-12)17(22)13-10-18-11-16(21)19-13/h2-5,12-13,18H,6-11H2,1H3,(H,19,21)
InChIKeyFKSMRQLYNMJWKB-UHFFFAOYSA-N
XLogP0.15
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(4S)-4-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]-1-methylimidazolidin-2-one
CID 95872118
4-[4-(2-ethoxyphenoxy)piperidine-1-carbonyl]imidazolidin-2-one
CID 71877831
2-hydroxy-1-[4-(2-methoxyphenoxy)piperidin-1-yl]ethanone
CID 70754980
5-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]-2-methyl-1H-pyridin-4-one
CID 70778695
[4-(2-methoxyphenoxy)piperidin-1-yl]-(4-methyl-1H-pyrrol-2-yl)methanone
CID 70758566
1H-indazol-3-yl-[4-(2-methoxyphenoxy)piperidin-1-yl]methanone
CID 70783899
5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyrrolidin-2-one
CID 14053707
(5S)-5-[4-(3,4-dimethylphenoxy)piperidine-1-carbonyl]pyrrolidin-2-one
CID 129368292
5-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]-1-methylpyridin-2-one
CID 70717882
[4-(2-methoxyphenoxy)piperidin-1-yl]-(2-methylfuran-3-yl)methanone
CID 70771871
methyl N-[2-[4-(2-methoxyphenoxy)piperidin-1-yl]-2-oxoethyl]carbamate
CID 70764459
2-(2-methoxyethoxy)-1-[4-(2-methoxyphenoxy)piperidin-1-yl]ethanone
CID 70748201

Frequently Asked Questions

What is the IUPAC name of 6-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]piperazin-2-one?
The IUPAC name of 6-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]piperazin-2-one (CID 70743927) is 6-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]piperazin-2-one.
What is the SMILES notation for 6-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]piperazin-2-one?
The canonical SMILES for 6-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]piperazin-2-one is COc1ccccc1OC1CCN(C(=O)C2CNCC(=O)N2)CC1.
What is the InChIKey of 6-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]piperazin-2-one?
The InChIKey is FKSMRQLYNMJWKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O4/c1-23-14-4-2-3-5-15(14)24-12-6-8-20(9-7-12)17(22)13-10-18-11-16(21)19-13/h2-5,12-13,18H,6-11H2,1H3,(H,19,21).
What are the key properties of 6-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]piperazin-2-one?
6-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]piperazin-2-one has a molecular weight of 333.39 g/mol, XLogP of 0.15, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]piperazin-2-one is sourced from PubChem (CID 70743927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).