N-ethyl-3-methyl-1-quinoxalin-5-ylpentan-1-amine

C16H23N3 — CID 105138311

IUPACN-ethyl-3-methyl-1-quinoxalin-5-ylpentan-1-amine
SMILESCCNC(CC(C)CC)c1cccc2nccnc12
InChIInChI=1S/C16H23N3/c1-4-12(3)11-15(17-5-2)13-7-6-8-14-16(13)19-10-9-18-14/h6-10,12,15,17H,4-5,11H2,1-3H3
InChIKeyUNCMOUCLNTZVJG-UHFFFAOYSA-N
MW257.38 g/mol
LogP3.72
Rot. Bonds6

About N-ethyl-3-methyl-1-quinoxalin-5-ylpentan-1-amine

N-ethyl-3-methyl-1-quinoxalin-5-ylpentan-1-amine (PubChem CID 105138311) has the molecular formula C16H23N3 and a molecular weight of 257.38 g/mol. Its IUPAC name is N-ethyl-3-methyl-1-quinoxalin-5-ylpentan-1-amine.

Molecular Properties

Compound NameN-ethyl-3-methyl-1-quinoxalin-5-ylpentan-1-amine
PubChem CID105138311
Molecular FormulaC16H23N3
Molecular Weight257.38 g/mol
Exact Mass257.19
IUPAC NameN-ethyl-3-methyl-1-quinoxalin-5-ylpentan-1-amine
SMILESCCNC(CC(C)CC)c1cccc2nccnc12
InChIInChI=1S/C16H23N3/c1-4-12(3)11-15(17-5-2)13-7-6-8-14-16(13)19-10-9-18-14/h6-10,12,15,17H,4-5,11H2,1-3H3
InChIKeyUNCMOUCLNTZVJG-UHFFFAOYSA-N
XLogP3.72
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-quinoxalin-5-ylbut-3-yn-1-amine
CID 105077278
N-ethyl-1-quinoxalin-5-ylheptan-1-amine
CID 105125906
N-ethyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine
CID 105157998
N-ethyl-2-(1-methylimidazol-2-yl)-1-quinoxalin-5-ylethanamine
CID 105167077
N-ethyl-3-methylsulfonyl-1-quinoxalin-5-ylpropan-1-amine
CID 114984120
5-butan-2-ylquinoxaline
CID 123654553
N-ethyl-3-methyl-1-naphthalen-1-ylpentan-1-amine
CID 63416227
N,3-diethyl-1-quinolin-5-ylpentan-1-amine
CID 105176769
N-ethyl-3-methyl-1-quinolin-3-ylpentan-1-amine
CID 115798075
N-propyl-1-quinoxalin-5-ylhexan-1-amine
CID 105129498
(1S)-N-methyl-1-quinoxalin-5-ylethanamine
CID 131196182
4,4,4-trifluoro-N-propyl-1-quinoxalin-5-ylbutan-1-amine
CID 105156277

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-methyl-1-quinoxalin-5-ylpentan-1-amine?
The IUPAC name of N-ethyl-3-methyl-1-quinoxalin-5-ylpentan-1-amine (CID 105138311) is N-ethyl-3-methyl-1-quinoxalin-5-ylpentan-1-amine.
What is the SMILES notation for N-ethyl-3-methyl-1-quinoxalin-5-ylpentan-1-amine?
The canonical SMILES for N-ethyl-3-methyl-1-quinoxalin-5-ylpentan-1-amine is CCNC(CC(C)CC)c1cccc2nccnc12.
What is the InChIKey of N-ethyl-3-methyl-1-quinoxalin-5-ylpentan-1-amine?
The InChIKey is UNCMOUCLNTZVJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3/c1-4-12(3)11-15(17-5-2)13-7-6-8-14-16(13)19-10-9-18-14/h6-10,12,15,17H,4-5,11H2,1-3H3.
What are the key properties of N-ethyl-3-methyl-1-quinoxalin-5-ylpentan-1-amine?
N-ethyl-3-methyl-1-quinoxalin-5-ylpentan-1-amine has a molecular weight of 257.38 g/mol, XLogP of 3.72, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-methyl-1-quinoxalin-5-ylpentan-1-amine is sourced from PubChem (CID 105138311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).