1-(3-methoxyphenyl)-4-(5-methyl-1-propylpyrazole-4-carbonyl)piperazin-2-one

C19H24N4O3 — CID 70788872

IUPAC1-(3-methoxyphenyl)-4-(5-methyl-1-propylpyrazole-4-carbonyl)piperazin-2-one
SMILESCCCn1ncc(C(=O)N2CCN(c3cccc(OC)c3)C(=O)C2)c1C
InChIInChI=1S/C19H24N4O3/c1-4-8-23-14(2)17(12-20-23)19(25)21-9-10-22(18(24)13-21)15-6-5-7-16(11-15)26-3/h5-7,11-12H,4,8-10,13H2,1-3H3
InChIKeyABVGHMIPKWVDHF-UHFFFAOYSA-N
MW356.43 g/mol
LogP2.10
Rot. Bonds5

About 1-(3-methoxyphenyl)-4-(5-methyl-1-propylpyrazole-4-carbonyl)piperazin-2-one

1-(3-methoxyphenyl)-4-(5-methyl-1-propylpyrazole-4-carbonyl)piperazin-2-one (PubChem CID 70788872) has the molecular formula C19H24N4O3 and a molecular weight of 356.43 g/mol. Its IUPAC name is 1-(3-methoxyphenyl)-4-(5-methyl-1-propylpyrazole-4-carbonyl)piperazin-2-one.

Molecular Properties

Compound Name1-(3-methoxyphenyl)-4-(5-methyl-1-propylpyrazole-4-carbonyl)piperazin-2-one
PubChem CID70788872
Molecular FormulaC19H24N4O3
Molecular Weight356.43 g/mol
Exact Mass356.18
IUPAC Name1-(3-methoxyphenyl)-4-(5-methyl-1-propylpyrazole-4-carbonyl)piperazin-2-one
SMILESCCCn1ncc(C(=O)N2CCN(c3cccc(OC)c3)C(=O)C2)c1C
InChIInChI=1S/C19H24N4O3/c1-4-8-23-14(2)17(12-20-23)19(25)21-9-10-22(18(24)13-21)15-6-5-7-16(11-15)26-3/h5-7,11-12H,4,8-10,13H2,1-3H3
InChIKeyABVGHMIPKWVDHF-UHFFFAOYSA-N
XLogP2.10
TPSA67.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-(6-aminopyridine-3-carbonyl)-1-(3-methoxyphenyl)piperazin-2-one
CID 70717844
1-(3-methoxyphenyl)-4-(4-pyrazol-1-ylbutanoyl)piperazin-2-one
CID 118765217
4-[4-(3-methoxyphenyl)-3-oxopiperazine-1-carbonyl]benzonitrile
CID 70735758
N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-5-methyl-1-propylpyrazole-4-carboxamide
CID 45187769
4-[2-(3-methoxyphenyl)acetyl]-1-phenylpiperazin-2-one
CID 110708431
1-[4-[4-(5-methyl-1-propylpyrazole-4-carbonyl)piperazin-1-yl]phenyl]ethanone
CID 72849446
1-(3-methoxyphenyl)-4-[(2R)-2-phenoxypropanoyl]piperazin-2-one
CID 96571058
1-(3-methoxyphenyl)-4-[(3R)-3-phenylbutanoyl]piperazin-2-one
CID 96577420
N-[(3-methoxyphenyl)methyl]-N'-methyl-4-(1-methylpyrazol-4-yl)-3-oxopiperazine-1-carboximidamide
CID 109434491
(4S)-4-acetamido-5-[4-(3-methoxyphenyl)-3-oxopiperazin-1-yl]-5-oxopentanamide
CID 70714332
1-(3-methoxyphenyl)-4-[3-[(2R)-1-methylpiperidin-2-yl]propanoyl]piperazin-2-one
CID 97188104
1-(4-methoxyphenyl)-4-(6-methylpyridine-2-carbonyl)piperazin-2-one
CID 70722598

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyphenyl)-4-(5-methyl-1-propylpyrazole-4-carbonyl)piperazin-2-one?
The IUPAC name of 1-(3-methoxyphenyl)-4-(5-methyl-1-propylpyrazole-4-carbonyl)piperazin-2-one (CID 70788872) is 1-(3-methoxyphenyl)-4-(5-methyl-1-propylpyrazole-4-carbonyl)piperazin-2-one.
What is the SMILES notation for 1-(3-methoxyphenyl)-4-(5-methyl-1-propylpyrazole-4-carbonyl)piperazin-2-one?
The canonical SMILES for 1-(3-methoxyphenyl)-4-(5-methyl-1-propylpyrazole-4-carbonyl)piperazin-2-one is CCCn1ncc(C(=O)N2CCN(c3cccc(OC)c3)C(=O)C2)c1C.
What is the InChIKey of 1-(3-methoxyphenyl)-4-(5-methyl-1-propylpyrazole-4-carbonyl)piperazin-2-one?
The InChIKey is ABVGHMIPKWVDHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O3/c1-4-8-23-14(2)17(12-20-23)19(25)21-9-10-22(18(24)13-21)15-6-5-7-16(11-15)26-3/h5-7,11-12H,4,8-10,13H2,1-3H3.
What are the key properties of 1-(3-methoxyphenyl)-4-(5-methyl-1-propylpyrazole-4-carbonyl)piperazin-2-one?
1-(3-methoxyphenyl)-4-(5-methyl-1-propylpyrazole-4-carbonyl)piperazin-2-one has a molecular weight of 356.43 g/mol, XLogP of 2.10, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyphenyl)-4-(5-methyl-1-propylpyrazole-4-carbonyl)piperazin-2-one is sourced from PubChem (CID 70788872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).