N-[2-(dimethylamino)ethyl]-3-ethoxyquinoxaline-2-carboxamide

C15H20N4O2 — CID 53322760

IUPACN-[2-(dimethylamino)ethyl]-3-ethoxyquinoxaline-2-carboxamide
SMILESCCOc1nc2ccccc2nc1C(=O)NCCN(C)C
InChIInChI=1S/C15H20N4O2/c1-4-21-15-13(14(20)16-9-10-19(2)3)17-11-7-5-6-8-12(11)18-15/h5-8H,4,9-10H2,1-3H3,(H,16,20)
InChIKeyAVHOTWICIHTGOL-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.32
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-3-ethoxyquinoxaline-2-carboxamide

N-[2-(dimethylamino)ethyl]-3-ethoxyquinoxaline-2-carboxamide (PubChem CID 53322760) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-3-ethoxyquinoxaline-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-3-ethoxyquinoxaline-2-carboxamide
PubChem CID53322760
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC NameN-[2-(dimethylamino)ethyl]-3-ethoxyquinoxaline-2-carboxamide
SMILESCCOc1nc2ccccc2nc1C(=O)NCCN(C)C
InChIInChI=1S/C15H20N4O2/c1-4-21-15-13(14(20)16-9-10-19(2)3)17-11-7-5-6-8-12(11)18-15/h5-8H,4,9-10H2,1-3H3,(H,16,20)
InChIKeyAVHOTWICIHTGOL-UHFFFAOYSA-N
XLogP1.32
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-3-ethoxyquinoxaline-2-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-3-ethoxyquinoxaline-2-carboxamide (CID 53322760) is N-[2-(dimethylamino)ethyl]-3-ethoxyquinoxaline-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-3-ethoxyquinoxaline-2-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-3-ethoxyquinoxaline-2-carboxamide is CCOc1nc2ccccc2nc1C(=O)NCCN(C)C.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-3-ethoxyquinoxaline-2-carboxamide?
The InChIKey is AVHOTWICIHTGOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-4-21-15-13(14(20)16-9-10-19(2)3)17-11-7-5-6-8-12(11)18-15/h5-8H,4,9-10H2,1-3H3,(H,16,20).
What are the key properties of N-[2-(dimethylamino)ethyl]-3-ethoxyquinoxaline-2-carboxamide?
N-[2-(dimethylamino)ethyl]-3-ethoxyquinoxaline-2-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 1.32, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-3-ethoxyquinoxaline-2-carboxamide is sourced from PubChem (CID 53322760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).