1-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-piperazin-1-ylethanone

C15H22N4O — CID 63777523

IUPAC1-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-piperazin-1-ylethanone
SMILESCN1CCN(C(=O)CN2CCNCC2)c2ccccc21
InChIInChI=1S/C15H22N4O/c1-17-10-11-19(14-5-3-2-4-13(14)17)15(20)12-18-8-6-16-7-9-18/h2-5,16H,6-12H2,1H3
InChIKeyJNENQMJFOGFTJK-UHFFFAOYSA-N
MW274.37 g/mol
LogP0.37
Rot. Bonds2

About 1-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-piperazin-1-ylethanone

1-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-piperazin-1-ylethanone (PubChem CID 63777523) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is 1-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-piperazin-1-ylethanone.

Molecular Properties

Compound Name1-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-piperazin-1-ylethanone
PubChem CID63777523
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC Name1-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-piperazin-1-ylethanone
SMILESCN1CCN(C(=O)CN2CCNCC2)c2ccccc21
InChIInChI=1S/C15H22N4O/c1-17-10-11-19(14-5-3-2-4-13(14)17)15(20)12-18-8-6-16-7-9-18/h2-5,16H,6-12H2,1H3
InChIKeyJNENQMJFOGFTJK-UHFFFAOYSA-N
XLogP0.37
TPSA38.82 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-bromo-1-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanone
CID 63778569
4-hydroxy-1-(4-methyl-2,3-dihydroquinoxalin-1-yl)butan-1-one
CID 79192627
N-methyl-3-(4-methyl-2,3-dihydroquinoxalin-1-yl)-3-oxopropanamide
CID 89467898
1-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-(4-sulfanylphenyl)ethanone
CID 107030058
2-(1,4-diazepan-1-yl)-1-(2,3-dihydro-1,4-benzoxazin-4-yl)ethanone
CID 62838358
N-ethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide
CID 115683493
2-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-oxoethoxy]acetic acid
CID 63778022
N-ethyl-3-(4-methyl-2,3-dihydroquinoxalin-1-yl)-3-oxopropanamide
CID 67472733
1-(4-methyl-2,3-dihydroquinoxalin-1-yl)-3-piperidin-3-ylbutan-1-one
CID 119859394
(3-ethylpyrrolidin-3-yl)-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone
CID 63776796
N,N-diethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide
CID 115641411
4-methyl-2,3-dihydroquinoxaline-1-carbohydrazide
CID 63776473

Frequently Asked Questions

What is the IUPAC name of 1-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-piperazin-1-ylethanone?
The IUPAC name of 1-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-piperazin-1-ylethanone (CID 63777523) is 1-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-piperazin-1-ylethanone.
What is the SMILES notation for 1-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-piperazin-1-ylethanone?
The canonical SMILES for 1-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-piperazin-1-ylethanone is CN1CCN(C(=O)CN2CCNCC2)c2ccccc21.
What is the InChIKey of 1-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-piperazin-1-ylethanone?
The InChIKey is JNENQMJFOGFTJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-17-10-11-19(14-5-3-2-4-13(14)17)15(20)12-18-8-6-16-7-9-18/h2-5,16H,6-12H2,1H3.
What are the key properties of 1-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-piperazin-1-ylethanone?
1-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-piperazin-1-ylethanone has a molecular weight of 274.37 g/mol, XLogP of 0.37, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-piperazin-1-ylethanone is sourced from PubChem (CID 63777523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).