2-(4-benzyl-3-oxopiperazin-2-yl)-N,N-dipropylacetamide;hydrochloride

C19H30ClN3O2 — CID 110283148

IUPAC2-(4-benzyl-3-oxopiperazin-2-yl)-N,N-dipropylacetamide;hydrochloride
SMILESCCCN(CCC)C(=O)CC1NCCN(Cc2ccccc2)C1=O.Cl
InChIInChI=1S/C19H29N3O2.ClH/c1-3-11-21(12-4-2)18(23)14-17-19(24)22(13-10-20-17)15-16-8-6-5-7-9-16;/h5-9,17,20H,3-4,10-15H2,1-2H3;1H
InChIKeyFFEFLXVQIUEYQW-UHFFFAOYSA-N
MW367.92 g/mol
LogP2.45
Rot. Bonds8

About 2-(4-benzyl-3-oxopiperazin-2-yl)-N,N-dipropylacetamide;hydrochloride

2-(4-benzyl-3-oxopiperazin-2-yl)-N,N-dipropylacetamide;hydrochloride (PubChem CID 110283148) has the molecular formula C19H30ClN3O2 and a molecular weight of 367.92 g/mol. Its IUPAC name is 2-(4-benzyl-3-oxopiperazin-2-yl)-N,N-dipropylacetamide;hydrochloride.

Molecular Properties

Compound Name2-(4-benzyl-3-oxopiperazin-2-yl)-N,N-dipropylacetamide;hydrochloride
PubChem CID110283148
Molecular FormulaC19H30ClN3O2
Molecular Weight367.92 g/mol
Exact Mass367.20
IUPAC Name2-(4-benzyl-3-oxopiperazin-2-yl)-N,N-dipropylacetamide;hydrochloride
SMILESCCCN(CCC)C(=O)CC1NCCN(Cc2ccccc2)C1=O.Cl
InChIInChI=1S/C19H29N3O2.ClH/c1-3-11-21(12-4-2)18(23)14-17-19(24)22(13-10-20-17)15-16-8-6-5-7-9-16;/h5-9,17,20H,3-4,10-15H2,1-2H3;1H
InChIKeyFFEFLXVQIUEYQW-UHFFFAOYSA-N
XLogP2.45
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.92
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-benzyl-3-oxopiperazin-2-yl)-N,N-dipropylacetamide
CID 110283149
2-(4-benzyl-3-oxopiperazin-2-yl)-N,N-diethylacetamide;hydrochloride
CID 110283124
2-(4-benzyl-3-oxopiperazin-2-yl)acetamide;hydrochloride
CID 110283164
2-[4-(2-methoxyethyl)-3-oxopiperazin-2-yl]-N,N-dipropylacetamide;hydrochloride
CID 110282954
(3S)-1-benzyl-3-ethylpiperazin-2-one
CID 45095306
2-(4-benzyl-3-oxopiperazin-2-yl)-N-[2-(dimethylamino)ethyl]acetamide
CID 110283183
3-[2-(azepan-1-yl)-2-oxoethyl]-1-benzylpiperazin-2-one
CID 110283147
N-benzyl-2-[4-(cyclopropylmethyl)-3-oxopiperazin-2-yl]-N-methylacetamide;hydrochloride
CID 110282667
N-(2-hydroxyethyl)-N-methyl-2-[3-oxo-4-(3-phenylpropyl)piperazin-2-yl]acetamide
CID 110283222
2-(4-benzyl-3-oxopiperazin-2-yl)-N-cyclopropylacetamide
CID 110283187
1-benzyl-3-[2-(2-fluorophenyl)-2-oxoethyl]piperazin-2-one
CID 102002003
2-(4-benzyl-3-oxopiperazin-2-yl)-N-cyclohexylacetamide;hydrochloride
CID 110283193

Frequently Asked Questions

What is the IUPAC name of 2-(4-benzyl-3-oxopiperazin-2-yl)-N,N-dipropylacetamide;hydrochloride?
The IUPAC name of 2-(4-benzyl-3-oxopiperazin-2-yl)-N,N-dipropylacetamide;hydrochloride (CID 110283148) is 2-(4-benzyl-3-oxopiperazin-2-yl)-N,N-dipropylacetamide;hydrochloride.
What is the SMILES notation for 2-(4-benzyl-3-oxopiperazin-2-yl)-N,N-dipropylacetamide;hydrochloride?
The canonical SMILES for 2-(4-benzyl-3-oxopiperazin-2-yl)-N,N-dipropylacetamide;hydrochloride is CCCN(CCC)C(=O)CC1NCCN(Cc2ccccc2)C1=O.Cl.
What is the InChIKey of 2-(4-benzyl-3-oxopiperazin-2-yl)-N,N-dipropylacetamide;hydrochloride?
The InChIKey is FFEFLXVQIUEYQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O2.ClH/c1-3-11-21(12-4-2)18(23)14-17-19(24)22(13-10-20-17)15-16-8-6-5-7-9-16;/h5-9,17,20H,3-4,10-15H2,1-2H3;1H.
What are the key properties of 2-(4-benzyl-3-oxopiperazin-2-yl)-N,N-dipropylacetamide;hydrochloride?
2-(4-benzyl-3-oxopiperazin-2-yl)-N,N-dipropylacetamide;hydrochloride has a molecular weight of 367.92 g/mol, XLogP of 2.45, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-benzyl-3-oxopiperazin-2-yl)-N,N-dipropylacetamide;hydrochloride is sourced from PubChem (CID 110283148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).