N-ethyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine

C17H18N4 — CID 105157998

IUPACN-ethyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine
SMILESCCNC(Cc1ccccn1)c1cccc2nccnc12
InChIInChI=1S/C17H18N4/c1-2-18-16(12-13-6-3-4-9-19-13)14-7-5-8-15-17(14)21-11-10-20-15/h3-11,16,18H,2,12H2,1H3
InChIKeyWVAGVDNDQWSPRB-UHFFFAOYSA-N
MW278.36 g/mol
LogP2.92
Rot. Bonds5

About N-ethyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine

N-ethyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine (PubChem CID 105157998) has the molecular formula C17H18N4 and a molecular weight of 278.36 g/mol. Its IUPAC name is N-ethyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine.

Molecular Properties

Compound NameN-ethyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine
PubChem CID105157998
Molecular FormulaC17H18N4
Molecular Weight278.36 g/mol
Exact Mass278.15
IUPAC NameN-ethyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine
SMILESCCNC(Cc1ccccn1)c1cccc2nccnc12
InChIInChI=1S/C17H18N4/c1-2-18-16(12-13-6-3-4-9-19-13)14-7-5-8-15-17(14)21-11-10-20-15/h3-11,16,18H,2,12H2,1H3
InChIKeyWVAGVDNDQWSPRB-UHFFFAOYSA-N
XLogP2.92
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine
CID 105158086
(2-pyridin-2-yl-1-quinoxalin-5-ylethyl)hydrazine
CID 105315352
N-ethyl-2-pyridin-2-yl-1-quinolin-4-ylethanamine
CID 105158093
N-ethyl-1-(2-methylphenyl)-2-pyridin-2-ylethanamine
CID 60819742
1-(2,3-difluorophenyl)-N-ethyl-2-pyridin-2-ylethanamine
CID 63988196
(1S)-N-ethyl-1-phenyl-2-pyridin-2-ylethanamine
CID 129365604
N-ethyl-1-quinoxalin-5-ylbut-3-yn-1-amine
CID 105077278
N-ethyl-2-(1-methylimidazol-2-yl)-1-quinoxalin-5-ylethanamine
CID 105167077
N-ethyl-3-methyl-1-quinoxalin-5-ylpentan-1-amine
CID 105138311
N-ethyl-1-quinoxalin-5-ylheptan-1-amine
CID 105125906
N-ethyl-1-(4-methyl-3-pyridinyl)-2-pyridin-2-ylethanamine
CID 66273129
N-ethyl-3-methylsulfonyl-1-quinoxalin-5-ylpropan-1-amine
CID 114984120

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine?
The IUPAC name of N-ethyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine (CID 105157998) is N-ethyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine.
What is the SMILES notation for N-ethyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine?
The canonical SMILES for N-ethyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine is CCNC(Cc1ccccn1)c1cccc2nccnc12.
What is the InChIKey of N-ethyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine?
The InChIKey is WVAGVDNDQWSPRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4/c1-2-18-16(12-13-6-3-4-9-19-13)14-7-5-8-15-17(14)21-11-10-20-15/h3-11,16,18H,2,12H2,1H3.
What are the key properties of N-ethyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine?
N-ethyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine has a molecular weight of 278.36 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine is sourced from PubChem (CID 105157998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).