N-(1-amino-2,3-dimethylbutan-2-yl)quinoxaline-6-carboxamide

C15H20N4O — CID 115310480

IUPACN-(1-amino-2,3-dimethylbutan-2-yl)quinoxaline-6-carboxamide
SMILESCC(C)C(C)(CN)NC(=O)c1ccc2nccnc2c1
InChIInChI=1S/C15H20N4O/c1-10(2)15(3,9-16)19-14(20)11-4-5-12-13(8-11)18-7-6-17-12/h4-8,10H,9,16H2,1-3H3,(H,19,20)
InChIKeyKIQCRFNTSSCMPG-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.73
Rot. Bonds4

About N-(1-amino-2,3-dimethylbutan-2-yl)quinoxaline-6-carboxamide

N-(1-amino-2,3-dimethylbutan-2-yl)quinoxaline-6-carboxamide (PubChem CID 115310480) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is N-(1-amino-2,3-dimethylbutan-2-yl)quinoxaline-6-carboxamide.

Molecular Properties

Compound NameN-(1-amino-2,3-dimethylbutan-2-yl)quinoxaline-6-carboxamide
PubChem CID115310480
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC NameN-(1-amino-2,3-dimethylbutan-2-yl)quinoxaline-6-carboxamide
SMILESCC(C)C(C)(CN)NC(=O)c1ccc2nccnc2c1
InChIInChI=1S/C15H20N4O/c1-10(2)15(3,9-16)19-14(20)11-4-5-12-13(8-11)18-7-6-17-12/h4-8,10H,9,16H2,1-3H3,(H,19,20)
InChIKeyKIQCRFNTSSCMPG-UHFFFAOYSA-N
XLogP1.73
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-amino-2,3-dimethylbutan-2-yl)-4-chloro-3-methylbenzamide
CID 112701453
N-(1-amino-2,3-dimethylbutan-2-yl)-3,4-dimethylbenzamide;hydrochloride
CID 119608726
3-N-(1-amino-2,3-dimethylbutan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide
CID 119609065
N-(1-amino-2,3-dimethylbutan-2-yl)naphthalene-2-carboxamide
CID 81486115
N-(1-amino-2,3-dimethylbutan-2-yl)-3-pyrazin-2-yloxybenzamide
CID 119607218
N-(1-amino-2,3-dimethylbutan-2-yl)-3-iodobenzamide;hydrochloride
CID 119605904
N-(1-amino-2,3-dimethylbutan-2-yl)-3-fluorobenzamide;hydrochloride
CID 119605448
N-(1-amino-2,3-dimethylbutan-2-yl)-6-(trifluoromethyl)pyridine-3-carboxamide;dihydrochloride
CID 119607870
N-(1-amino-2,3-dimethylbutan-2-yl)-2,3-dioxo-1,4-dihydroquinoxaline-6-carboxamide;hydrochloride
CID 119607727
N-(1-amino-2,3-dimethylbutan-2-yl)-5-hydroxypyridine-3-carboxamide
CID 113283967
N-(2-methylpropoxy)quinoxaline-6-carboxamide
CID 113304462
N-(1-amino-2,3-dimethylbutan-2-yl)-4-phenylbenzamide;hydrochloride
CID 119608679

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2,3-dimethylbutan-2-yl)quinoxaline-6-carboxamide?
The IUPAC name of N-(1-amino-2,3-dimethylbutan-2-yl)quinoxaline-6-carboxamide (CID 115310480) is N-(1-amino-2,3-dimethylbutan-2-yl)quinoxaline-6-carboxamide.
What is the SMILES notation for N-(1-amino-2,3-dimethylbutan-2-yl)quinoxaline-6-carboxamide?
The canonical SMILES for N-(1-amino-2,3-dimethylbutan-2-yl)quinoxaline-6-carboxamide is CC(C)C(C)(CN)NC(=O)c1ccc2nccnc2c1.
What is the InChIKey of N-(1-amino-2,3-dimethylbutan-2-yl)quinoxaline-6-carboxamide?
The InChIKey is KIQCRFNTSSCMPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-10(2)15(3,9-16)19-14(20)11-4-5-12-13(8-11)18-7-6-17-12/h4-8,10H,9,16H2,1-3H3,(H,19,20).
What are the key properties of N-(1-amino-2,3-dimethylbutan-2-yl)quinoxaline-6-carboxamide?
N-(1-amino-2,3-dimethylbutan-2-yl)quinoxaline-6-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 1.73, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2,3-dimethylbutan-2-yl)quinoxaline-6-carboxamide is sourced from PubChem (CID 115310480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).