4-methoxy-N,4-dimethyl-1-quinoxalin-5-ylpentan-1-amine

C16H23N3O — CID 103032278

IUPAC4-methoxy-N,4-dimethyl-1-quinoxalin-5-ylpentan-1-amine
SMILESCNC(CCC(C)(C)OC)c1cccc2nccnc12
InChIInChI=1S/C16H23N3O/c1-16(2,20-4)9-8-13(17-3)12-6-5-7-14-15(12)19-11-10-18-14/h5-7,10-11,13,17H,8-9H2,1-4H3
InChIKeyHPPPAWDXGPMYRE-UHFFFAOYSA-N
MW273.38 g/mol
LogP3.10
Rot. Bonds6

About 4-methoxy-N,4-dimethyl-1-quinoxalin-5-ylpentan-1-amine

4-methoxy-N,4-dimethyl-1-quinoxalin-5-ylpentan-1-amine (PubChem CID 103032278) has the molecular formula C16H23N3O and a molecular weight of 273.38 g/mol. Its IUPAC name is 4-methoxy-N,4-dimethyl-1-quinoxalin-5-ylpentan-1-amine.

Molecular Properties

Compound Name4-methoxy-N,4-dimethyl-1-quinoxalin-5-ylpentan-1-amine
PubChem CID103032278
Molecular FormulaC16H23N3O
Molecular Weight273.38 g/mol
Exact Mass273.18
IUPAC Name4-methoxy-N,4-dimethyl-1-quinoxalin-5-ylpentan-1-amine
SMILESCNC(CCC(C)(C)OC)c1cccc2nccnc12
InChIInChI=1S/C16H23N3O/c1-16(2,20-4)9-8-13(17-3)12-6-5-7-14-15(12)19-11-10-18-14/h5-7,10-11,13,17H,8-9H2,1-4H3
InChIKeyHPPPAWDXGPMYRE-UHFFFAOYSA-N
XLogP3.10
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1-quinoxalin-5-ylheptan-1-amine
CID 105126260
1-[2-fluoro-3-(trifluoromethyl)phenyl]-4-methoxy-N,4-dimethylpentan-1-amine
CID 103032263
N-methyl-2-propoxy-1-quinoxalin-5-ylethanamine
CID 105165419
N-methyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine
CID 105158086
4,4,4-trifluoro-N-propyl-1-quinoxalin-5-ylbutan-1-amine
CID 105156277
(1S)-N-methyl-1-quinoxalin-5-ylethanamine
CID 131196182
1-(3-ethyl-2-pyridinyl)-4-methoxy-N,4-dimethylpentan-1-amine
CID 103036007
1-(4-chloro-2-fluorophenyl)-4-methoxy-N,4-dimethylpentan-1-amine
CID 103031675
(4-methoxy-4-methyl-1-quinoxalin-6-ylpentyl)hydrazine
CID 103026296
N-methyl-1-phenyl-1-quinoxalin-5-ylmethanamine
CID 105084067
2-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-quinoxalin-5-ylethanamine
CID 105158647
5-methoxy-N,5-dimethyl-1-phenoxyhexan-2-amine
CID 103031640

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N,4-dimethyl-1-quinoxalin-5-ylpentan-1-amine?
The IUPAC name of 4-methoxy-N,4-dimethyl-1-quinoxalin-5-ylpentan-1-amine (CID 103032278) is 4-methoxy-N,4-dimethyl-1-quinoxalin-5-ylpentan-1-amine.
What is the SMILES notation for 4-methoxy-N,4-dimethyl-1-quinoxalin-5-ylpentan-1-amine?
The canonical SMILES for 4-methoxy-N,4-dimethyl-1-quinoxalin-5-ylpentan-1-amine is CNC(CCC(C)(C)OC)c1cccc2nccnc12.
What is the InChIKey of 4-methoxy-N,4-dimethyl-1-quinoxalin-5-ylpentan-1-amine?
The InChIKey is HPPPAWDXGPMYRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O/c1-16(2,20-4)9-8-13(17-3)12-6-5-7-14-15(12)19-11-10-18-14/h5-7,10-11,13,17H,8-9H2,1-4H3.
What are the key properties of 4-methoxy-N,4-dimethyl-1-quinoxalin-5-ylpentan-1-amine?
4-methoxy-N,4-dimethyl-1-quinoxalin-5-ylpentan-1-amine has a molecular weight of 273.38 g/mol, XLogP of 3.10, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N,4-dimethyl-1-quinoxalin-5-ylpentan-1-amine is sourced from PubChem (CID 103032278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).