N-ethyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoxaline-5-carboxamide

C15H23N3O — CID 104614558

IUPACN-ethyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoxaline-5-carboxamide
SMILESCCN(CC(C)C)C(=O)c1cccc2c1NCCN2
InChIInChI=1S/C15H23N3O/c1-4-18(10-11(2)3)15(19)12-6-5-7-13-14(12)17-9-8-16-13/h5-7,11,16-17H,4,8-10H2,1-3H3
InChIKeyKCGWHENPRVBDJV-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.64
Rot. Bonds4

About N-ethyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoxaline-5-carboxamide

N-ethyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoxaline-5-carboxamide (PubChem CID 104614558) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-ethyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoxaline-5-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoxaline-5-carboxamide
PubChem CID104614558
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-ethyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoxaline-5-carboxamide
SMILESCCN(CC(C)C)C(=O)c1cccc2c1NCCN2
InChIInChI=1S/C15H23N3O/c1-4-18(10-11(2)3)15(19)12-6-5-7-13-14(12)17-9-8-16-13/h5-7,11,16-17H,4,8-10H2,1-3H3
InChIKeyKCGWHENPRVBDJV-UHFFFAOYSA-N
XLogP2.64
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(4-methylpentan-2-yl)-1,2,3,4-tetrahydroquinoxaline-5-carboxamide
CID 104614808
N-(3-methylbutyl)-1,2,3,4-tetrahydroquinoxaline-5-carboxamide
CID 104614369
N-ethyl-3-hydroxy-2-methyl-N-(2-methylpropyl)benzamide
CID 82830028
N-propyl-1,2,3,4-tetrahydroquinoxaline-5-carboxamide
CID 104614467
N-(2-hydroxyethyl)-N-methyl-1,2,3,4-tetrahydroquinoxaline-5-carboxamide
CID 113433226
N-ethyl-3-fluoro-2-(methylamino)-N-(2-methylpropyl)benzamide
CID 62648944
3-amino-2-chloro-N-ethyl-N-(2-methylpropyl)benzamide
CID 112574718
N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoline-5-carboxamide
CID 62849738
N-ethyl-N-(2-methylpropyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43273795
N-[4-(dimethylamino)butan-2-yl]-1,2,3,4-tetrahydroquinoxaline-5-carboxamide
CID 104614770
N-[2-(dimethylsulfamoyl)ethyl]-1,2,3,4-tetrahydroquinoxaline-5-carboxamide
CID 106339594
N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 62215091

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoxaline-5-carboxamide?
The IUPAC name of N-ethyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoxaline-5-carboxamide (CID 104614558) is N-ethyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoxaline-5-carboxamide.
What is the SMILES notation for N-ethyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoxaline-5-carboxamide?
The canonical SMILES for N-ethyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoxaline-5-carboxamide is CCN(CC(C)C)C(=O)c1cccc2c1NCCN2.
What is the InChIKey of N-ethyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoxaline-5-carboxamide?
The InChIKey is KCGWHENPRVBDJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-4-18(10-11(2)3)15(19)12-6-5-7-13-14(12)17-9-8-16-13/h5-7,11,16-17H,4,8-10H2,1-3H3.
What are the key properties of N-ethyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoxaline-5-carboxamide?
N-ethyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoxaline-5-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.64, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoxaline-5-carboxamide is sourced from PubChem (CID 104614558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).