N-(piperidin-3-ylmethyl)quinoxaline-5-carboxamide

C15H18N4O — CID 104615453

IUPACN-(piperidin-3-ylmethyl)quinoxaline-5-carboxamide
SMILESO=C(NCC1CCCNC1)c1cccc2nccnc12
InChIInChI=1S/C15H18N4O/c20-15(19-10-11-3-2-6-16-9-11)12-4-1-5-13-14(12)18-8-7-17-13/h1,4-5,7-8,11,16H,2-3,6,9-10H2,(H,19,20)
InChIKeyYFGLQLUWIXQERY-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.36
Rot. Bonds3

About N-(piperidin-3-ylmethyl)quinoxaline-5-carboxamide

N-(piperidin-3-ylmethyl)quinoxaline-5-carboxamide (PubChem CID 104615453) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is N-(piperidin-3-ylmethyl)quinoxaline-5-carboxamide.

Molecular Properties

Compound NameN-(piperidin-3-ylmethyl)quinoxaline-5-carboxamide
PubChem CID104615453
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC NameN-(piperidin-3-ylmethyl)quinoxaline-5-carboxamide
SMILESO=C(NCC1CCCNC1)c1cccc2nccnc12
InChIInChI=1S/C15H18N4O/c20-15(19-10-11-3-2-6-16-9-11)12-4-1-5-13-14(12)18-8-7-17-13/h1,4-5,7-8,11,16H,2-3,6,9-10H2,(H,19,20)
InChIKeyYFGLQLUWIXQERY-UHFFFAOYSA-N
XLogP1.36
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide;dihydrochloride
CID 119462332
2-methyl-N-(piperidin-3-ylmethyl)quinoline-8-carboxamide
CID 119460242
N-[(2-bromocyclohexyl)methyl]quinoxaline-5-carboxamide
CID 104615763
2-iodo-3-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 113265456
N-(piperidin-3-ylmethyl)quinoline-6-carboxamide
CID 62874382
2-morpholin-4-yl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide
CID 119461977
N-[2-methyl-6-(piperidin-3-ylmethylcarbamoyl)phenyl]pyridine-4-carboxamide;dihydrochloride
CID 119461431
2-methyl-N-(pyrrolidin-3-ylmethyl)pyridine-3-carboxamide
CID 80564265
N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119461032
2-benzyl-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119462305
2-phenylsulfanyl-N-(piperidin-3-ylmethyl)benzamide
CID 119464048
2-(4-fluorobenzoyl)-N-(piperidin-3-ylmethyl)benzamide
CID 119460024

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-3-ylmethyl)quinoxaline-5-carboxamide?
The IUPAC name of N-(piperidin-3-ylmethyl)quinoxaline-5-carboxamide (CID 104615453) is N-(piperidin-3-ylmethyl)quinoxaline-5-carboxamide.
What is the SMILES notation for N-(piperidin-3-ylmethyl)quinoxaline-5-carboxamide?
The canonical SMILES for N-(piperidin-3-ylmethyl)quinoxaline-5-carboxamide is O=C(NCC1CCCNC1)c1cccc2nccnc12.
What is the InChIKey of N-(piperidin-3-ylmethyl)quinoxaline-5-carboxamide?
The InChIKey is YFGLQLUWIXQERY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c20-15(19-10-11-3-2-6-16-9-11)12-4-1-5-13-14(12)18-8-7-17-13/h1,4-5,7-8,11,16H,2-3,6,9-10H2,(H,19,20).
What are the key properties of N-(piperidin-3-ylmethyl)quinoxaline-5-carboxamide?
N-(piperidin-3-ylmethyl)quinoxaline-5-carboxamide has a molecular weight of 270.34 g/mol, XLogP of 1.36, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-3-ylmethyl)quinoxaline-5-carboxamide is sourced from PubChem (CID 104615453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).