2-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-quinoxalin-5-ylethanamine

C16H19N5 — CID 105158647

IUPAC2-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-quinoxalin-5-ylethanamine
SMILESCNC(Cc1cc(C)nn1C)c1cccc2nccnc12
InChIInChI=1S/C16H19N5/c1-11-9-12(21(3)20-11)10-15(17-2)13-5-4-6-14-16(13)19-8-7-18-14/h4-9,15,17H,10H2,1-3H3
InChIKeySEAXQCLHMNSZEW-UHFFFAOYSA-N
MW281.36 g/mol
LogP2.17
Rot. Bonds4

About 2-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-quinoxalin-5-ylethanamine

2-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-quinoxalin-5-ylethanamine (PubChem CID 105158647) has the molecular formula C16H19N5 and a molecular weight of 281.36 g/mol. Its IUPAC name is 2-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-quinoxalin-5-ylethanamine.

Molecular Properties

Compound Name2-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-quinoxalin-5-ylethanamine
PubChem CID105158647
Molecular FormulaC16H19N5
Molecular Weight281.36 g/mol
Exact Mass281.16
IUPAC Name2-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-quinoxalin-5-ylethanamine
SMILESCNC(Cc1cc(C)nn1C)c1cccc2nccnc12
InChIInChI=1S/C16H19N5/c1-11-9-12(21(3)20-11)10-15(17-2)13-5-4-6-14-16(13)19-8-7-18-14/h4-9,15,17H,10H2,1-3H3
InChIKeySEAXQCLHMNSZEW-UHFFFAOYSA-N
XLogP2.17
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-quinoxalin-5-ylethanamine with MolForge

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Related Compounds

1-(3-chloro-2-methylphenyl)-2-(2,5-dimethylpyrazol-3-yl)-N-methylethanamine
CID 107102582
1-(3-bromo-2-chlorophenyl)-2-(2,5-dimethylpyrazol-3-yl)-N-methylethanamine
CID 104996334
N-methyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine
CID 105158086
2-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-(3-propoxyphenyl)ethanamine
CID 104996199
1-(5-chloro-2-fluorophenyl)-2-(2,5-dimethylpyrazol-3-yl)-N-methylethanamine
CID 114886219
1-(2,5-dimethoxyphenyl)-2-(2,5-dimethylpyrazol-3-yl)-N-methylethanamine
CID 104996375
2-(2-ethyl-5-methylpyrazol-3-yl)-1-quinoxalin-5-ylethanamine
CID 105162303
(1S)-N-methyl-1-quinoxalin-5-ylethanamine
CID 131196182
2-(2,5-dimethylpyrazol-3-yl)-1-(2,6-dimethyl-4-pyridinyl)-N-methylethanamine
CID 107503617
2-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-(3-methylthiophen-2-yl)ethanamine
CID 104996357
N-methyl-1-quinoxalin-5-ylheptan-1-amine
CID 105126260
2-(2,5-dimethylpyrazol-3-yl)-1-(2-fluoro-4-methoxyphenyl)-N-methylethanamine
CID 81304748

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-quinoxalin-5-ylethanamine?
The IUPAC name of 2-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-quinoxalin-5-ylethanamine (CID 105158647) is 2-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-quinoxalin-5-ylethanamine.
What is the SMILES notation for 2-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-quinoxalin-5-ylethanamine?
The canonical SMILES for 2-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-quinoxalin-5-ylethanamine is CNC(Cc1cc(C)nn1C)c1cccc2nccnc12.
What is the InChIKey of 2-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-quinoxalin-5-ylethanamine?
The InChIKey is SEAXQCLHMNSZEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5/c1-11-9-12(21(3)20-11)10-15(17-2)13-5-4-6-14-16(13)19-8-7-18-14/h4-9,15,17H,10H2,1-3H3.
What are the key properties of 2-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-quinoxalin-5-ylethanamine?
2-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-quinoxalin-5-ylethanamine has a molecular weight of 281.36 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-quinoxalin-5-ylethanamine is sourced from PubChem (CID 105158647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).