N-piperazin-1-yl-2-(2,4,6-trimethylphenyl)acetamide

C15H23N3O — CID 154489626

IUPACN-piperazin-1-yl-2-(2,4,6-trimethylphenyl)acetamide
SMILESCc1cc(C)c(CC(=O)NN2CCNCC2)c(C)c1
InChIInChI=1S/C15H23N3O/c1-11-8-12(2)14(13(3)9-11)10-15(19)17-18-6-4-16-5-7-18/h8-9,16H,4-7,10H2,1-3H3,(H,17,19)
InChIKeyIVOFBCYSXDHQPQ-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.09
Rot. Bonds3

About N-piperazin-1-yl-2-(2,4,6-trimethylphenyl)acetamide

N-piperazin-1-yl-2-(2,4,6-trimethylphenyl)acetamide (PubChem CID 154489626) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-piperazin-1-yl-2-(2,4,6-trimethylphenyl)acetamide.

Molecular Properties

Compound NameN-piperazin-1-yl-2-(2,4,6-trimethylphenyl)acetamide
PubChem CID154489626
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-piperazin-1-yl-2-(2,4,6-trimethylphenyl)acetamide
SMILESCc1cc(C)c(CC(=O)NN2CCNCC2)c(C)c1
InChIInChI=1S/C15H23N3O/c1-11-8-12(2)14(13(3)9-11)10-15(19)17-18-6-4-16-5-7-18/h8-9,16H,4-7,10H2,1-3H3,(H,17,19)
InChIKeyIVOFBCYSXDHQPQ-UHFFFAOYSA-N
XLogP1.09
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-hydroxy-2-(2,4,6-trimethylphenyl)acetamide
CID 139860051
(2,4,6-trimethylphenyl)methyl 1,4-diazepane-1-carboxylate
CID 90924240
N-propan-2-yl-2-(2,4,6-trimethylphenyl)acetamide
CID 110767844
N',N'-dimethyl-2-(2,4,6-trimethylphenyl)acetohydrazide
CID 116847434
1-[2-(2,4,6-trimethylphenyl)ethyl]piperazine
CID 15391878
1-[4-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-3-yl)piperidin-1-yl]-2-(2,4,6-trimethylphenyl)ethanone;hydrochloride
CID 120824133
ethyl N-piperazin-1-ylcarbamate
CID 13200156
1-(2-ethyl-4,6-dimethylphenyl)piperazine
CID 59119296
N-phenyl-2-(2,4,6-trimethylphenyl)acetamide
CID 42390776
(1R,5S)-3-[2-(2,4,6-trimethylphenyl)acetyl]-3-azabicyclo[3.1.0]hexane-1,5-dicarboxylic acid
CID 135110128
3-methyl-3-pyrrolidin-1-yl-1-(2,4,6-trimethylphenyl)butan-2-one
CID 79056346
2-(4-cyano-2,6-dimethylphenyl)-N-[2-(4-piperazin-1-ylphenyl)ethyl]acetamide
CID 166286647

Frequently Asked Questions

What is the IUPAC name of N-piperazin-1-yl-2-(2,4,6-trimethylphenyl)acetamide?
The IUPAC name of N-piperazin-1-yl-2-(2,4,6-trimethylphenyl)acetamide (CID 154489626) is N-piperazin-1-yl-2-(2,4,6-trimethylphenyl)acetamide.
What is the SMILES notation for N-piperazin-1-yl-2-(2,4,6-trimethylphenyl)acetamide?
The canonical SMILES for N-piperazin-1-yl-2-(2,4,6-trimethylphenyl)acetamide is Cc1cc(C)c(CC(=O)NN2CCNCC2)c(C)c1.
What is the InChIKey of N-piperazin-1-yl-2-(2,4,6-trimethylphenyl)acetamide?
The InChIKey is IVOFBCYSXDHQPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11-8-12(2)14(13(3)9-11)10-15(19)17-18-6-4-16-5-7-18/h8-9,16H,4-7,10H2,1-3H3,(H,17,19).
What are the key properties of N-piperazin-1-yl-2-(2,4,6-trimethylphenyl)acetamide?
N-piperazin-1-yl-2-(2,4,6-trimethylphenyl)acetamide has a molecular weight of 261.37 g/mol, XLogP of 1.09, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperazin-1-yl-2-(2,4,6-trimethylphenyl)acetamide is sourced from PubChem (CID 154489626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).