4-[2-(diethylamino)ethoxy]-N-(2-piperazin-1-ylethyl)benzamide

C19H32N4O2 — CID 119448581

IUPAC4-[2-(diethylamino)ethoxy]-N-(2-piperazin-1-ylethyl)benzamide
SMILESCCN(CC)CCOc1ccc(C(=O)NCCN2CCNCC2)cc1
InChIInChI=1S/C19H32N4O2/c1-3-22(4-2)15-16-25-18-7-5-17(6-8-18)19(24)21-11-14-23-12-9-20-10-13-23/h5-8,20H,3-4,9-16H2,1-2H3,(H,21,24)
InChIKeySHGAUGCOGQLXPG-UHFFFAOYSA-N
MW348.49 g/mol
LogP1.04
Rot. Bonds10

About 4-[2-(diethylamino)ethoxy]-N-(2-piperazin-1-ylethyl)benzamide

4-[2-(diethylamino)ethoxy]-N-(2-piperazin-1-ylethyl)benzamide (PubChem CID 119448581) has the molecular formula C19H32N4O2 and a molecular weight of 348.49 g/mol. Its IUPAC name is 4-[2-(diethylamino)ethoxy]-N-(2-piperazin-1-ylethyl)benzamide.

Molecular Properties

Compound Name4-[2-(diethylamino)ethoxy]-N-(2-piperazin-1-ylethyl)benzamide
PubChem CID119448581
Molecular FormulaC19H32N4O2
Molecular Weight348.49 g/mol
Exact Mass348.25
IUPAC Name4-[2-(diethylamino)ethoxy]-N-(2-piperazin-1-ylethyl)benzamide
SMILESCCN(CC)CCOc1ccc(C(=O)NCCN2CCNCC2)cc1
InChIInChI=1S/C19H32N4O2/c1-3-22(4-2)15-16-25-18-7-5-17(6-8-18)19(24)21-11-14-23-12-9-20-10-13-23/h5-8,20H,3-4,9-16H2,1-2H3,(H,21,24)
InChIKeySHGAUGCOGQLXPG-UHFFFAOYSA-N
XLogP1.04
TPSA56.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.49
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-methoxyethoxy)-N-(3-piperazin-1-ylpropyl)benzamide
CID 119392575
N-(2-piperazin-1-ylethyl)-3-propoxybenzamide
CID 62050340
N-(2-morpholin-4-ylethyl)-4-propoxybenzamide chloride
CID 53352023
4-(cyclohexylmethoxy)-N-(2-piperazin-1-ylethyl)benzamide
CID 119448595
4-fluoro-N-(2-piperazin-1-ylethyl)benzamide
CID 10753244
4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methoxy]-N-(2-piperazin-1-ylethyl)benzamide
CID 119446462
4-ethoxy-N-(2-piperidin-1-ylethyl)benzamide
CID 25237098
3-(2-methoxyethoxy)-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride
CID 119444759
3-ethoxy-N-(2-piperazin-1-ylethyl)benzamide
CID 119447922
4-(4-ethoxyphenoxy)-N-(2-piperazin-1-ylethyl)butanamide;hydrochloride
CID 119445383
4-(2-amino-2-oxoethoxy)-N-(3-piperazin-1-ylpropyl)benzamide
CID 119391361
4-(methylaminomethyl)-N-(2-piperazin-1-ylethyl)benzamide
CID 90338095

Frequently Asked Questions

What is the IUPAC name of 4-[2-(diethylamino)ethoxy]-N-(2-piperazin-1-ylethyl)benzamide?
The IUPAC name of 4-[2-(diethylamino)ethoxy]-N-(2-piperazin-1-ylethyl)benzamide (CID 119448581) is 4-[2-(diethylamino)ethoxy]-N-(2-piperazin-1-ylethyl)benzamide.
What is the SMILES notation for 4-[2-(diethylamino)ethoxy]-N-(2-piperazin-1-ylethyl)benzamide?
The canonical SMILES for 4-[2-(diethylamino)ethoxy]-N-(2-piperazin-1-ylethyl)benzamide is CCN(CC)CCOc1ccc(C(=O)NCCN2CCNCC2)cc1.
What is the InChIKey of 4-[2-(diethylamino)ethoxy]-N-(2-piperazin-1-ylethyl)benzamide?
The InChIKey is SHGAUGCOGQLXPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N4O2/c1-3-22(4-2)15-16-25-18-7-5-17(6-8-18)19(24)21-11-14-23-12-9-20-10-13-23/h5-8,20H,3-4,9-16H2,1-2H3,(H,21,24).
What are the key properties of 4-[2-(diethylamino)ethoxy]-N-(2-piperazin-1-ylethyl)benzamide?
4-[2-(diethylamino)ethoxy]-N-(2-piperazin-1-ylethyl)benzamide has a molecular weight of 348.49 g/mol, XLogP of 1.04, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(diethylamino)ethoxy]-N-(2-piperazin-1-ylethyl)benzamide is sourced from PubChem (CID 119448581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).