N-[2-(1-quinoxalin-2-ylpiperidin-4-yl)pyrazol-3-yl]acetamide

C18H20N6O — CID 56746669

IUPACN-[2-(1-quinoxalin-2-ylpiperidin-4-yl)pyrazol-3-yl]acetamide
SMILESCC(=O)Nc1ccnn1C1CCN(c2cnc3ccccc3n2)CC1
InChIInChI=1S/C18H20N6O/c1-13(25)21-17-6-9-20-24(17)14-7-10-23(11-8-14)18-12-19-15-4-2-3-5-16(15)22-18/h2-6,9,12,14H,7-8,10-11H2,1H3,(H,21,25)
InChIKeyVMJDICFSVDIPEC-UHFFFAOYSA-N
MW336.40 g/mol
LogP2.63
Rot. Bonds3

About N-[2-(1-quinoxalin-2-ylpiperidin-4-yl)pyrazol-3-yl]acetamide

N-[2-(1-quinoxalin-2-ylpiperidin-4-yl)pyrazol-3-yl]acetamide (PubChem CID 56746669) has the molecular formula C18H20N6O and a molecular weight of 336.40 g/mol. Its IUPAC name is N-[2-(1-quinoxalin-2-ylpiperidin-4-yl)pyrazol-3-yl]acetamide.

Molecular Properties

Compound NameN-[2-(1-quinoxalin-2-ylpiperidin-4-yl)pyrazol-3-yl]acetamide
PubChem CID56746669
Molecular FormulaC18H20N6O
Molecular Weight336.40 g/mol
Exact Mass336.17
IUPAC NameN-[2-(1-quinoxalin-2-ylpiperidin-4-yl)pyrazol-3-yl]acetamide
SMILESCC(=O)Nc1ccnn1C1CCN(c2cnc3ccccc3n2)CC1
InChIInChI=1S/C18H20N6O/c1-13(25)21-17-6-9-20-24(17)14-7-10-23(11-8-14)18-12-19-15-4-2-3-5-16(15)22-18/h2-6,9,12,14H,7-8,10-11H2,1H3,(H,21,25)
InChIKeyVMJDICFSVDIPEC-UHFFFAOYSA-N
XLogP2.63
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-propan-2-ylpiperidin-1-yl)quinoxaline
CID 59598901
N-(1-quinoxalin-2-ylpiperidin-4-yl)benzamide
CID 33378138
1-[2-[1-(2-aminopyrimidin-4-yl)piperidin-4-yl]pyrazol-3-yl]-3-(2-methylphenyl)urea
CID 56754329
1-quinoxalin-2-ylazepane-4-carboxylic acid
CID 139695402
N-(3,4-dimethylphenyl)-1-quinoxalin-2-ylpiperidine-4-carboxamide
CID 16813344
2-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]quinoxaline
CID 126947471
tert-butyl N-(1-quinoxalin-2-ylpiperidin-4-yl)carbamate
CID 71632141
(3S)-N-cyclopropyl-1-(1-quinoxalin-2-ylpiperidin-4-yl)piperidine-3-carboxamide
CID 95550020
N-(3-chloro-4-methylphenyl)-1-quinoxalin-2-ylpiperidine-4-carboxamide
CID 16875988
N-(1-quinoxalin-2-ylpiperidin-4-yl)pyrazine-2-carboxamide
CID 172903561
N,2,2-trimethyl-N-[(1-quinoxalin-2-ylpiperidin-4-yl)methyl]propanamide
CID 171702415
N-(3-methoxyphenyl)-1-quinoxalin-2-ylpiperidine-4-carboxamide
CID 16875982

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-quinoxalin-2-ylpiperidin-4-yl)pyrazol-3-yl]acetamide?
The IUPAC name of N-[2-(1-quinoxalin-2-ylpiperidin-4-yl)pyrazol-3-yl]acetamide (CID 56746669) is N-[2-(1-quinoxalin-2-ylpiperidin-4-yl)pyrazol-3-yl]acetamide.
What is the SMILES notation for N-[2-(1-quinoxalin-2-ylpiperidin-4-yl)pyrazol-3-yl]acetamide?
The canonical SMILES for N-[2-(1-quinoxalin-2-ylpiperidin-4-yl)pyrazol-3-yl]acetamide is CC(=O)Nc1ccnn1C1CCN(c2cnc3ccccc3n2)CC1.
What is the InChIKey of N-[2-(1-quinoxalin-2-ylpiperidin-4-yl)pyrazol-3-yl]acetamide?
The InChIKey is VMJDICFSVDIPEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N6O/c1-13(25)21-17-6-9-20-24(17)14-7-10-23(11-8-14)18-12-19-15-4-2-3-5-16(15)22-18/h2-6,9,12,14H,7-8,10-11H2,1H3,(H,21,25).
What are the key properties of N-[2-(1-quinoxalin-2-ylpiperidin-4-yl)pyrazol-3-yl]acetamide?
N-[2-(1-quinoxalin-2-ylpiperidin-4-yl)pyrazol-3-yl]acetamide has a molecular weight of 336.40 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-quinoxalin-2-ylpiperidin-4-yl)pyrazol-3-yl]acetamide is sourced from PubChem (CID 56746669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).