N-benzyl-2-(4-propan-2-ylpiperazin-1-yl)acetamide

C16H25N3O — CID 30636979

IUPACN-benzyl-2-(4-propan-2-ylpiperazin-1-yl)acetamide
SMILESCC(C)N1CCN(CC(=O)NCc2ccccc2)CC1
InChIInChI=1S/C16H25N3O/c1-14(2)19-10-8-18(9-11-19)13-16(20)17-12-15-6-4-3-5-7-15/h3-7,14H,8-13H2,1-2H3,(H,17,20)
InChIKeyHYCUBFJHJNZQJG-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.33
Rot. Bonds5

About N-benzyl-2-(4-propan-2-ylpiperazin-1-yl)acetamide

N-benzyl-2-(4-propan-2-ylpiperazin-1-yl)acetamide (PubChem CID 30636979) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is N-benzyl-2-(4-propan-2-ylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-benzyl-2-(4-propan-2-ylpiperazin-1-yl)acetamide
PubChem CID30636979
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC NameN-benzyl-2-(4-propan-2-ylpiperazin-1-yl)acetamide
SMILESCC(C)N1CCN(CC(=O)NCc2ccccc2)CC1
InChIInChI=1S/C16H25N3O/c1-14(2)19-10-8-18(9-11-19)13-16(20)17-12-15-6-4-3-5-7-15/h3-7,14H,8-13H2,1-2H3,(H,17,20)
InChIKeyHYCUBFJHJNZQJG-UHFFFAOYSA-N
XLogP1.33
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-2-[4,7-bis(2-hydroxypropyl)-1,4,7-triazonan-1-yl]acetamide
CID 163526789
N-benzyl-2-[4-(1-oxo-1-phenylpropan-2-yl)piperazin-1-yl]acetamide;hydrochloride
CID 141035294
N-[(2-chlorophenyl)methyl]-2-(4-propan-2-ylpiperazin-1-yl)acetamide
CID 34773522
(2S)-2-[4-[2-(benzylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-methylphenyl)propanamide
CID 30637178
N-(furan-2-ylmethyl)-2-(4-propan-2-ylpiperazin-1-yl)acetamide
CID 34773300
N-[1-[4-[2-(benzylamino)-2-oxoethyl]piperazin-1-yl]-1-oxopropan-2-yl]benzamide
CID 55495610
2-[4-[2-(benzylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-thiophen-2-ylethyl)propanamide
CID 78835231
2-(4-benzylpiperazin-1-yl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]acetamide
CID 30863248
N-[(4-methylphenyl)methyl]-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide
CID 34943408
2-[4-[2-[benzhydryl(methyl)amino]-2-oxoethyl]piperazin-1-yl]-N-benzylacetamide
CID 55494313
N-benzyl-2-[4-[2-(benzylcarbamoylamino)-3-methylbutanoyl]piperazin-1-yl]acetamide
CID 55543585
N-benzyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]acetamide
CID 30636341

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(4-propan-2-ylpiperazin-1-yl)acetamide?
The IUPAC name of N-benzyl-2-(4-propan-2-ylpiperazin-1-yl)acetamide (CID 30636979) is N-benzyl-2-(4-propan-2-ylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-benzyl-2-(4-propan-2-ylpiperazin-1-yl)acetamide?
The canonical SMILES for N-benzyl-2-(4-propan-2-ylpiperazin-1-yl)acetamide is CC(C)N1CCN(CC(=O)NCc2ccccc2)CC1.
What is the InChIKey of N-benzyl-2-(4-propan-2-ylpiperazin-1-yl)acetamide?
The InChIKey is HYCUBFJHJNZQJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-14(2)19-10-8-18(9-11-19)13-16(20)17-12-15-6-4-3-5-7-15/h3-7,14H,8-13H2,1-2H3,(H,17,20).
What are the key properties of N-benzyl-2-(4-propan-2-ylpiperazin-1-yl)acetamide?
N-benzyl-2-(4-propan-2-ylpiperazin-1-yl)acetamide has a molecular weight of 275.40 g/mol, XLogP of 1.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(4-propan-2-ylpiperazin-1-yl)acetamide is sourced from PubChem (CID 30636979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).