2-[4-(2-methoxyethyl)piperazin-1-yl]benzamide

C14H21N3O2 — CID 91343454

IUPAC2-[4-(2-methoxyethyl)piperazin-1-yl]benzamide
SMILESCOCCN1CCN(c2ccccc2C(N)=O)CC1
InChIInChI=1S/C14H21N3O2/c1-19-11-10-16-6-8-17(9-7-16)13-5-3-2-4-12(13)14(15)18/h2-5H,6-11H2,1H3,(H2,15,18)
InChIKeyAZSANEIDWGSWKB-UHFFFAOYSA-N
MW263.34 g/mol
LogP0.55
Rot. Bonds5

About 2-[4-(2-methoxyethyl)piperazin-1-yl]benzamide

2-[4-(2-methoxyethyl)piperazin-1-yl]benzamide (PubChem CID 91343454) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-[4-(2-methoxyethyl)piperazin-1-yl]benzamide.

Molecular Properties

Compound Name2-[4-(2-methoxyethyl)piperazin-1-yl]benzamide
PubChem CID91343454
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name2-[4-(2-methoxyethyl)piperazin-1-yl]benzamide
SMILESCOCCN1CCN(c2ccccc2C(N)=O)CC1
InChIInChI=1S/C14H21N3O2/c1-19-11-10-16-6-8-17(9-7-16)13-5-3-2-4-12(13)14(15)18/h2-5H,6-11H2,1H3,(H2,15,18)
InChIKeyAZSANEIDWGSWKB-UHFFFAOYSA-N
XLogP0.55
TPSA58.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methylsulfonylpiperazin-1-yl)benzamide
CID 153409878
2-[4-(2-hydroxyethyl)piperazin-1-yl]benzoic acid
CID 25360108
methyl 2-(4-ethylpiperazin-1-yl)benzoate
CID 99973041
2-[4-(2-methoxyethyl)piperazin-1-yl]pyrimidine-5-carboxamide
CID 142706032
3-[4-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 10849160
propyl 2-[4-(3-chloropropyl)piperazin-1-yl]benzoate
CID 10616008
2-[4-(2-methylphenyl)piperazin-1-yl]acetamide
CID 3088677
3-[4-(2-methoxyethyl)piperazin-1-yl]-1-phenylpropan-1-one
CID 118909812
N'-hydroxy-2-(4-propylpiperazin-1-yl)benzenecarboximidamide
CID 43199964
1-[2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]phenyl]ethanone
CID 60699160
[2-fluoro-3-[4-(2-methoxyethyl)piperazin-1-yl]phenyl] methanesulfonate
CID 57447993
N'-(2-methoxyethyl)-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]oxamide
CID 42268802

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methoxyethyl)piperazin-1-yl]benzamide?
The IUPAC name of 2-[4-(2-methoxyethyl)piperazin-1-yl]benzamide (CID 91343454) is 2-[4-(2-methoxyethyl)piperazin-1-yl]benzamide.
What is the SMILES notation for 2-[4-(2-methoxyethyl)piperazin-1-yl]benzamide?
The canonical SMILES for 2-[4-(2-methoxyethyl)piperazin-1-yl]benzamide is COCCN1CCN(c2ccccc2C(N)=O)CC1.
What is the InChIKey of 2-[4-(2-methoxyethyl)piperazin-1-yl]benzamide?
The InChIKey is AZSANEIDWGSWKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-19-11-10-16-6-8-17(9-7-16)13-5-3-2-4-12(13)14(15)18/h2-5H,6-11H2,1H3,(H2,15,18).
What are the key properties of 2-[4-(2-methoxyethyl)piperazin-1-yl]benzamide?
2-[4-(2-methoxyethyl)piperazin-1-yl]benzamide has a molecular weight of 263.34 g/mol, XLogP of 0.55, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methoxyethyl)piperazin-1-yl]benzamide is sourced from PubChem (CID 91343454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).