N-ethyl-3-methyl-1-quinoxalin-2-ylbutan-2-amine

C15H21N3 — CID 63201806

IUPACN-ethyl-3-methyl-1-quinoxalin-2-ylbutan-2-amine
SMILESCCNC(Cc1cnc2ccccc2n1)C(C)C
InChIInChI=1S/C15H21N3/c1-4-16-15(11(2)3)9-12-10-17-13-7-5-6-8-14(13)18-12/h5-8,10-11,15-16H,4,9H2,1-3H3
InChIKeyAHGUVUMMTGLPJS-UHFFFAOYSA-N
MW243.35 g/mol
LogP2.81
Rot. Bonds5

About N-ethyl-3-methyl-1-quinoxalin-2-ylbutan-2-amine

N-ethyl-3-methyl-1-quinoxalin-2-ylbutan-2-amine (PubChem CID 63201806) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is N-ethyl-3-methyl-1-quinoxalin-2-ylbutan-2-amine.

Molecular Properties

Compound NameN-ethyl-3-methyl-1-quinoxalin-2-ylbutan-2-amine
PubChem CID63201806
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC NameN-ethyl-3-methyl-1-quinoxalin-2-ylbutan-2-amine
SMILESCCNC(Cc1cnc2ccccc2n1)C(C)C
InChIInChI=1S/C15H21N3/c1-4-16-15(11(2)3)9-12-10-17-13-7-5-6-8-14(13)18-12/h5-8,10-11,15-16H,4,9H2,1-3H3
InChIKeyAHGUVUMMTGLPJS-UHFFFAOYSA-N
XLogP2.81
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-methyl-1-quinoxalin-2-ylbutan-2-amine?
The IUPAC name of N-ethyl-3-methyl-1-quinoxalin-2-ylbutan-2-amine (CID 63201806) is N-ethyl-3-methyl-1-quinoxalin-2-ylbutan-2-amine.
What is the SMILES notation for N-ethyl-3-methyl-1-quinoxalin-2-ylbutan-2-amine?
The canonical SMILES for N-ethyl-3-methyl-1-quinoxalin-2-ylbutan-2-amine is CCNC(Cc1cnc2ccccc2n1)C(C)C.
What is the InChIKey of N-ethyl-3-methyl-1-quinoxalin-2-ylbutan-2-amine?
The InChIKey is AHGUVUMMTGLPJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-4-16-15(11(2)3)9-12-10-17-13-7-5-6-8-14(13)18-12/h5-8,10-11,15-16H,4,9H2,1-3H3.
What are the key properties of N-ethyl-3-methyl-1-quinoxalin-2-ylbutan-2-amine?
N-ethyl-3-methyl-1-quinoxalin-2-ylbutan-2-amine has a molecular weight of 243.35 g/mol, XLogP of 2.81, 5 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-2-ylbutan-2-amine is sourced from PubChem (CID 63201806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).