1-[4-[1-(2-methoxyphenyl)ethyl]piperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone

C19H25N3O3 — CID 75375628

IUPAC1-[4-[1-(2-methoxyphenyl)ethyl]piperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone
SMILESCOc1ccccc1C(C)N1CCN(C(=O)Cc2cc(C)on2)CC1
InChIInChI=1S/C19H25N3O3/c1-14-12-16(20-25-14)13-19(23)22-10-8-21(9-11-22)15(2)17-6-4-5-7-18(17)24-3/h4-7,12,15H,8-11,13H2,1-3H3
InChIKeyUTVXTBQOSDCBCR-UHFFFAOYSA-N
MW343.43 g/mol
LogP2.44
Rot. Bonds5

About 1-[4-[1-(2-methoxyphenyl)ethyl]piperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone

1-[4-[1-(2-methoxyphenyl)ethyl]piperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone (PubChem CID 75375628) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is 1-[4-[1-(2-methoxyphenyl)ethyl]piperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone.

Molecular Properties

Compound Name1-[4-[1-(2-methoxyphenyl)ethyl]piperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone
PubChem CID75375628
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC Name1-[4-[1-(2-methoxyphenyl)ethyl]piperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone
SMILESCOc1ccccc1C(C)N1CCN(C(=O)Cc2cc(C)on2)CC1
InChIInChI=1S/C19H25N3O3/c1-14-12-16(20-25-14)13-19(23)22-10-8-21(9-11-22)15(2)17-6-4-5-7-18(17)24-3/h4-7,12,15H,8-11,13H2,1-3H3
InChIKeyUTVXTBQOSDCBCR-UHFFFAOYSA-N
XLogP2.44
TPSA58.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-[4-[1-(2-methoxyphenyl)ethyl]piperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone with MolForge

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Related Compounds

1-[(3S)-3-[(2-methoxyphenyl)methyl]piperidin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone
CID 95906930
1-[3-[(2-methoxyphenyl)methyl]piperidin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone
CID 75375614
2-(3,4-dimethoxyphenyl)-1-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-1-yl]ethanone
CID 110646397
2-(2,5-dimethoxyphenyl)-1-[4-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperazin-1-yl]ethanone
CID 78870625
2-(2-methoxyphenoxy)-1-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]-1,4-diazepan-1-yl]ethanone
CID 110646491
2-chloro-1-[4-[(1S)-1-(2,4-dimethoxyphenyl)ethyl]piperazin-1-yl]ethanone
CID 2051192
2-chloro-1-[4-[1-(2,4-dimethoxyphenyl)ethyl]piperazin-1-yl]ethanone
CID 2757465
1-[4-[1-(2-chlorophenyl)ethyl]piperazin-1-yl]-2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]ethanone
CID 55608796
1-[4-[1-(2,4-dimethoxyphenyl)ethyl]piperazin-1-yl]-3-(2-hydroxyphenoxy)propan-1-one
CID 4740668
2-(5-methyl-1,2-oxazol-3-yl)-1-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazin-1-yl]ethanone
CID 110610847
2-(3,4-dimethoxyphenyl)-1-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]-1,4-diazepan-1-yl]ethanone
CID 110646485
1-[2-(5-methyl-1,2-oxazol-3-yl)acetyl]piperidine-4-carboxylic acid
CID 110836609

Frequently Asked Questions

What is the IUPAC name of 1-[4-[1-(2-methoxyphenyl)ethyl]piperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone?
The IUPAC name of 1-[4-[1-(2-methoxyphenyl)ethyl]piperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone (CID 75375628) is 1-[4-[1-(2-methoxyphenyl)ethyl]piperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone.
What is the SMILES notation for 1-[4-[1-(2-methoxyphenyl)ethyl]piperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone?
The canonical SMILES for 1-[4-[1-(2-methoxyphenyl)ethyl]piperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone is COc1ccccc1C(C)N1CCN(C(=O)Cc2cc(C)on2)CC1.
What is the InChIKey of 1-[4-[1-(2-methoxyphenyl)ethyl]piperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone?
The InChIKey is UTVXTBQOSDCBCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-14-12-16(20-25-14)13-19(23)22-10-8-21(9-11-22)15(2)17-6-4-5-7-18(17)24-3/h4-7,12,15H,8-11,13H2,1-3H3.
What are the key properties of 1-[4-[1-(2-methoxyphenyl)ethyl]piperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone?
1-[4-[1-(2-methoxyphenyl)ethyl]piperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone has a molecular weight of 343.43 g/mol, XLogP of 2.44, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[1-(2-methoxyphenyl)ethyl]piperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone is sourced from PubChem (CID 75375628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).