1-(4-methoxyphenyl)-4-[(5-propylfuran-2-yl)methyl]piperazin-2-one

C19H24N2O3 — CID 70763198

IUPAC1-(4-methoxyphenyl)-4-[(5-propylfuran-2-yl)methyl]piperazin-2-one
SMILESCCCc1ccc(CN2CCN(c3ccc(OC)cc3)C(=O)C2)o1
InChIInChI=1S/C19H24N2O3/c1-3-4-17-9-10-18(24-17)13-20-11-12-21(19(22)14-20)15-5-7-16(23-2)8-6-15/h5-10H,3-4,11-14H2,1-2H3
InChIKeyHUGONKRFXZHOMF-UHFFFAOYSA-N
MW328.41 g/mol
LogP3.09
Rot. Bonds6

About 1-(4-methoxyphenyl)-4-[(5-propylfuran-2-yl)methyl]piperazin-2-one

1-(4-methoxyphenyl)-4-[(5-propylfuran-2-yl)methyl]piperazin-2-one (PubChem CID 70763198) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-4-[(5-propylfuran-2-yl)methyl]piperazin-2-one.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-4-[(5-propylfuran-2-yl)methyl]piperazin-2-one
PubChem CID70763198
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name1-(4-methoxyphenyl)-4-[(5-propylfuran-2-yl)methyl]piperazin-2-one
SMILESCCCc1ccc(CN2CCN(c3ccc(OC)cc3)C(=O)C2)o1
InChIInChI=1S/C19H24N2O3/c1-3-4-17-9-10-18(24-17)13-20-11-12-21(19(22)14-20)15-5-7-16(23-2)8-6-15/h5-10H,3-4,11-14H2,1-2H3
InChIKeyHUGONKRFXZHOMF-UHFFFAOYSA-N
XLogP3.09
TPSA45.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1,4-bis(4-methoxyphenyl)piperazine-2,5-dione
CID 585094
1-(4-methoxyphenyl)-4-[(5-methylfuran-2-yl)methyl]piperazine
CID 3717638
N-[(2R)-1-[4-(4-methoxyphenyl)-3-oxopiperazin-1-yl]-1-oxopentan-2-yl]acetamide
CID 96573729
(3S,4S)-4-(hydroxymethyl)-1-[(5-propylfuran-2-yl)methyl]piperidin-3-ol
CID 133125674
4-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]-1-(1-methylpyrazol-4-yl)piperazin-2-one
CID 97159814
(2S)-4-(4-methoxyphenyl)-2-methyl-N-[2-(5-methylfuran-2-yl)ethyl]-3-oxopiperazine-1-carboxamide
CID 126430620
4-[(2-fluoro-5-methoxyphenyl)methyl]-1-(1-methylpyrazol-4-yl)piperazin-2-one
CID 126796157
1-(4-methoxyphenyl)pyrrolidine-2,4-dione
CID 79515540
1-(4-methoxyphenyl)azepan-2-one
CID 66742326
[4-(4-methoxyphenyl)piperazin-1-yl]-[5-(piperidin-1-ylmethyl)furan-2-yl]methanone
CID 35333195
1-(3-methoxyphenyl)-4-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperazin-2-one
CID 29253890
3-(4-methoxyphenyl)-7-[(5-methylfuran-2-yl)methyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine
CID 53193651

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-4-[(5-propylfuran-2-yl)methyl]piperazin-2-one?
The IUPAC name of 1-(4-methoxyphenyl)-4-[(5-propylfuran-2-yl)methyl]piperazin-2-one (CID 70763198) is 1-(4-methoxyphenyl)-4-[(5-propylfuran-2-yl)methyl]piperazin-2-one.
What is the SMILES notation for 1-(4-methoxyphenyl)-4-[(5-propylfuran-2-yl)methyl]piperazin-2-one?
The canonical SMILES for 1-(4-methoxyphenyl)-4-[(5-propylfuran-2-yl)methyl]piperazin-2-one is CCCc1ccc(CN2CCN(c3ccc(OC)cc3)C(=O)C2)o1.
What is the InChIKey of 1-(4-methoxyphenyl)-4-[(5-propylfuran-2-yl)methyl]piperazin-2-one?
The InChIKey is HUGONKRFXZHOMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-3-4-17-9-10-18(24-17)13-20-11-12-21(19(22)14-20)15-5-7-16(23-2)8-6-15/h5-10H,3-4,11-14H2,1-2H3.
What are the key properties of 1-(4-methoxyphenyl)-4-[(5-propylfuran-2-yl)methyl]piperazin-2-one?
1-(4-methoxyphenyl)-4-[(5-propylfuran-2-yl)methyl]piperazin-2-one has a molecular weight of 328.41 g/mol, XLogP of 3.09, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-4-[(5-propylfuran-2-yl)methyl]piperazin-2-one is sourced from PubChem (CID 70763198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).