N-(1-benzylpiperidin-4-yl)-4-methyl-3-oxoquinoxaline-2-carboxamide

C22H24N4O2 — CID 46364995

IUPACN-(1-benzylpiperidin-4-yl)-4-methyl-3-oxoquinoxaline-2-carboxamide
SMILESCn1c(=O)c(C(=O)NC2CCN(Cc3ccccc3)CC2)nc2ccccc21
InChIInChI=1S/C22H24N4O2/c1-25-19-10-6-5-9-18(19)24-20(22(25)28)21(27)23-17-11-13-26(14-12-17)15-16-7-3-2-4-8-16/h2-10,17H,11-15H2,1H3,(H,23,27)
InChIKeyUZTPJLKZAKBMFF-UHFFFAOYSA-N
MW376.46 g/mol
LogP2.33
Rot. Bonds4

About N-(1-benzylpiperidin-4-yl)-4-methyl-3-oxoquinoxaline-2-carboxamide

N-(1-benzylpiperidin-4-yl)-4-methyl-3-oxoquinoxaline-2-carboxamide (PubChem CID 46364995) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is N-(1-benzylpiperidin-4-yl)-4-methyl-3-oxoquinoxaline-2-carboxamide.

Molecular Properties

Compound NameN-(1-benzylpiperidin-4-yl)-4-methyl-3-oxoquinoxaline-2-carboxamide
PubChem CID46364995
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC NameN-(1-benzylpiperidin-4-yl)-4-methyl-3-oxoquinoxaline-2-carboxamide
SMILESCn1c(=O)c(C(=O)NC2CCN(Cc3ccccc3)CC2)nc2ccccc21
InChIInChI=1S/C22H24N4O2/c1-25-19-10-6-5-9-18(19)24-20(22(25)28)21(27)23-17-11-13-26(14-12-17)15-16-7-3-2-4-8-16/h2-10,17H,11-15H2,1H3,(H,23,27)
InChIKeyUZTPJLKZAKBMFF-UHFFFAOYSA-N
XLogP2.33
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

CID 23643870
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CID 24768520
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CID 24768522
CID 24768522
CID 10217663
CID 10217663
CID 44416393
CID 44416393
CID 122188235
CID 122188235
CID 122188236
CID 122188236
CID 122188237
CID 122188237
CID 122188351
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CID 2806925
CID 2806925

Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-4-yl)-4-methyl-3-oxoquinoxaline-2-carboxamide?
The IUPAC name of N-(1-benzylpiperidin-4-yl)-4-methyl-3-oxoquinoxaline-2-carboxamide (CID 46364995) is N-(1-benzylpiperidin-4-yl)-4-methyl-3-oxoquinoxaline-2-carboxamide.
What is the SMILES notation for N-(1-benzylpiperidin-4-yl)-4-methyl-3-oxoquinoxaline-2-carboxamide?
The canonical SMILES for N-(1-benzylpiperidin-4-yl)-4-methyl-3-oxoquinoxaline-2-carboxamide is Cn1c(=O)c(C(=O)NC2CCN(Cc3ccccc3)CC2)nc2ccccc21.
What is the InChIKey of N-(1-benzylpiperidin-4-yl)-4-methyl-3-oxoquinoxaline-2-carboxamide?
The InChIKey is UZTPJLKZAKBMFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-25-19-10-6-5-9-18(19)24-20(22(25)28)21(27)23-17-11-13-26(14-12-17)15-16-7-3-2-4-8-16/h2-10,17H,11-15H2,1H3,(H,23,27).
What are the key properties of N-(1-benzylpiperidin-4-yl)-4-methyl-3-oxoquinoxaline-2-carboxamide?
N-(1-benzylpiperidin-4-yl)-4-methyl-3-oxoquinoxaline-2-carboxamide has a molecular weight of 376.46 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-4-yl)-4-methyl-3-oxoquinoxaline-2-carboxamide is sourced from PubChem (CID 46364995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).