2-benzamido-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride

C20H25ClN4O2 — CID 119447369

IUPAC2-benzamido-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride
SMILESCl.O=C(Nc1ccccc1C(=O)NCCN1CCNCC1)c1ccccc1
InChIInChI=1S/C20H24N4O2.ClH/c25-19(16-6-2-1-3-7-16)23-18-9-5-4-8-17(18)20(26)22-12-15-24-13-10-21-11-14-24;/h1-9,21H,10-15H2,(H,22,26)(H,23,25);1H
InChIKeyQDVJTFGGAXESFH-UHFFFAOYSA-N
MW388.90 g/mol
LogP2.00
Rot. Bonds6

About 2-benzamido-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride

2-benzamido-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride (PubChem CID 119447369) has the molecular formula C20H25ClN4O2 and a molecular weight of 388.90 g/mol. Its IUPAC name is 2-benzamido-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride.

Molecular Properties

Compound Name2-benzamido-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride
PubChem CID119447369
Molecular FormulaC20H25ClN4O2
Molecular Weight388.90 g/mol
Exact Mass388.17
IUPAC Name2-benzamido-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride
SMILESCl.O=C(Nc1ccccc1C(=O)NCCN1CCNCC1)c1ccccc1
InChIInChI=1S/C20H24N4O2.ClH/c25-19(16-6-2-1-3-7-16)23-18-9-5-4-8-17(18)20(26)22-12-15-24-13-10-21-11-14-24;/h1-9,21H,10-15H2,(H,22,26)(H,23,25);1H
InChIKeyQDVJTFGGAXESFH-UHFFFAOYSA-N
XLogP2.00
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.90
LogP ≤ 52.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-benzamido-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride
CID 119447831
3-benzamido-4-methyl-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride
CID 119447939
2-(2,2-dimethylpropanoylamino)-N-(2-piperazin-1-ylethyl)benzamide
CID 119448601
bis(2-benzamidobenzoic acid);piperazine
CID 3045073
3-hydroxy-N-(2-piperazin-1-ylethyl)benzamide
CID 43600333
4-fluoro-N-(2-piperazin-1-ylethyl)benzamide
CID 10753244
4-(phenylsulfanylmethyl)-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride
CID 119448902
N-(2-piperazin-1-ylethyl)-1-benzofuran-3-carboxamide;hydrochloride
CID 119449206
2-(2-fluoroanilino)-N-(2-piperazin-1-ylethyl)pyridine-3-carboxamide
CID 119444821
N-[4-oxo-4-(3-piperazin-1-ylpropylamino)butyl]benzamide
CID 119394389
N-[2-oxo-2-(3-piperazin-1-ylpropylamino)ethyl]benzamide;hydrochloride
CID 119393183
4-(phenylsulfanylmethyl)-N-(2-piperazin-1-ylethyl)benzamide
CID 119448903

Frequently Asked Questions

What is the IUPAC name of 2-benzamido-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride?
The IUPAC name of 2-benzamido-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride (CID 119447369) is 2-benzamido-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride.
What is the SMILES notation for 2-benzamido-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride?
The canonical SMILES for 2-benzamido-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride is Cl.O=C(Nc1ccccc1C(=O)NCCN1CCNCC1)c1ccccc1.
What is the InChIKey of 2-benzamido-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride?
The InChIKey is QDVJTFGGAXESFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O2.ClH/c25-19(16-6-2-1-3-7-16)23-18-9-5-4-8-17(18)20(26)22-12-15-24-13-10-21-11-14-24;/h1-9,21H,10-15H2,(H,22,26)(H,23,25);1H.
What are the key properties of 2-benzamido-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride?
2-benzamido-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride has a molecular weight of 388.90 g/mol, XLogP of 2.00, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzamido-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride is sourced from PubChem (CID 119447369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).