1-(2-methoxy-4-pyridinyl)-4-(3-phenylprop-2-enyl)piperazin-2-one

C19H21N3O2 — CID 171145881

IUPAC1-(2-methoxy-4-pyridinyl)-4-(3-phenylprop-2-enyl)piperazin-2-one
SMILESCOc1cc(N2CCN(CC=Cc3ccccc3)CC2=O)ccn1
InChIInChI=1S/C19H21N3O2/c1-24-18-14-17(9-10-20-18)22-13-12-21(15-19(22)23)11-5-8-16-6-3-2-4-7-16/h2-10,14H,11-13,15H2,1H3
InChIKeyULTATEVOFJHOOY-UHFFFAOYSA-N
MW323.40 g/mol
LogP2.45
Rot. Bonds5

About 1-(2-methoxy-4-pyridinyl)-4-(3-phenylprop-2-enyl)piperazin-2-one

1-(2-methoxy-4-pyridinyl)-4-(3-phenylprop-2-enyl)piperazin-2-one (PubChem CID 171145881) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is 1-(2-methoxy-4-pyridinyl)-4-(3-phenylprop-2-enyl)piperazin-2-one.

Molecular Properties

Compound Name1-(2-methoxy-4-pyridinyl)-4-(3-phenylprop-2-enyl)piperazin-2-one
PubChem CID171145881
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC Name1-(2-methoxy-4-pyridinyl)-4-(3-phenylprop-2-enyl)piperazin-2-one
SMILESCOc1cc(N2CCN(CC=Cc3ccccc3)CC2=O)ccn1
InChIInChI=1S/C19H21N3O2/c1-24-18-14-17(9-10-20-18)22-13-12-21(15-19(22)23)11-5-8-16-6-3-2-4-7-16/h2-10,14H,11-13,15H2,1H3
InChIKeyULTATEVOFJHOOY-UHFFFAOYSA-N
XLogP2.45
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-(2-methoxy-4-pyridinyl)-4-(3-phenylprop-2-enyl)piperazin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-methoxy-4-pyridinyl)-4-(1,3-thiazol-5-ylmethyl)piperazin-2-one
CID 155974357
1-(2-methoxy-4-pyridinyl)-4-(6-methoxypyrimidin-4-yl)piperazin-2-one
CID 155974547
4-cyclopropylsulfonyl-1-(2-methoxy-4-pyridinyl)piperazin-2-one
CID 139023028
4-(2,5-dimethylfuran-3-carbonyl)-1-(2-methoxy-4-pyridinyl)piperazin-2-one
CID 139023042
6-[4-(2-methoxy-4-pyridinyl)-3-oxopiperazin-1-yl]pyridine-3-carbonitrile
CID 139022978
1-phenyl-3-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]imidazolidine-2,4-dione
CID 55919363
1-(1-methylpyrazol-4-yl)-4-[3-(2-nitrophenyl)prop-2-enyl]piperazin-2-one
CID 126826964
N-(2-methoxyethyl)-4-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]pyrimidin-2-amine
CID 112885899
(2-methylpyrimidin-4-yl)-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methanone
CID 55854973
2-(3,4-dimethoxyphenyl)-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethanone
CID 6025296
2-methyl-6-(3-phenylprop-2-enyl)-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
CID 154740584
1-(4-bromo-3-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine
CID 10293563

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-4-pyridinyl)-4-(3-phenylprop-2-enyl)piperazin-2-one?
The IUPAC name of 1-(2-methoxy-4-pyridinyl)-4-(3-phenylprop-2-enyl)piperazin-2-one (CID 171145881) is 1-(2-methoxy-4-pyridinyl)-4-(3-phenylprop-2-enyl)piperazin-2-one.
What is the SMILES notation for 1-(2-methoxy-4-pyridinyl)-4-(3-phenylprop-2-enyl)piperazin-2-one?
The canonical SMILES for 1-(2-methoxy-4-pyridinyl)-4-(3-phenylprop-2-enyl)piperazin-2-one is COc1cc(N2CCN(CC=Cc3ccccc3)CC2=O)ccn1.
What is the InChIKey of 1-(2-methoxy-4-pyridinyl)-4-(3-phenylprop-2-enyl)piperazin-2-one?
The InChIKey is ULTATEVOFJHOOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-24-18-14-17(9-10-20-18)22-13-12-21(15-19(22)23)11-5-8-16-6-3-2-4-7-16/h2-10,14H,11-13,15H2,1H3.
What are the key properties of 1-(2-methoxy-4-pyridinyl)-4-(3-phenylprop-2-enyl)piperazin-2-one?
1-(2-methoxy-4-pyridinyl)-4-(3-phenylprop-2-enyl)piperazin-2-one has a molecular weight of 323.40 g/mol, XLogP of 2.45, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-4-pyridinyl)-4-(3-phenylprop-2-enyl)piperazin-2-one is sourced from PubChem (CID 171145881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).