N'-methyl-N'-propan-2-yl-N-quinoxalin-6-yloxamide

C14H16N4O2 — CID 99716975

IUPACN'-methyl-N'-propan-2-yl-N-quinoxalin-6-yloxamide
SMILESCC(C)N(C)C(=O)C(=O)Nc1ccc2nccnc2c1
InChIInChI=1S/C14H16N4O2/c1-9(2)18(3)14(20)13(19)17-10-4-5-11-12(8-10)16-7-6-15-11/h4-9H,1-3H3,(H,17,19)
InChIKeyCZMHZPBVRVGBPC-UHFFFAOYSA-N
MW272.31 g/mol
LogP1.44
Rot. Bonds2

About N'-methyl-N'-propan-2-yl-N-quinoxalin-6-yloxamide

N'-methyl-N'-propan-2-yl-N-quinoxalin-6-yloxamide (PubChem CID 99716975) has the molecular formula C14H16N4O2 and a molecular weight of 272.31 g/mol. Its IUPAC name is N'-methyl-N'-propan-2-yl-N-quinoxalin-6-yloxamide.

Molecular Properties

Compound NameN'-methyl-N'-propan-2-yl-N-quinoxalin-6-yloxamide
PubChem CID99716975
Molecular FormulaC14H16N4O2
Molecular Weight272.31 g/mol
Exact Mass272.13
IUPAC NameN'-methyl-N'-propan-2-yl-N-quinoxalin-6-yloxamide
SMILESCC(C)N(C)C(=O)C(=O)Nc1ccc2nccnc2c1
InChIInChI=1S/C14H16N4O2/c1-9(2)18(3)14(20)13(19)17-10-4-5-11-12(8-10)16-7-6-15-11/h4-9H,1-3H3,(H,17,19)
InChIKeyCZMHZPBVRVGBPC-UHFFFAOYSA-N
XLogP1.44
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

2-chloro-N-quinoxalin-6-ylpropanamide
CID 60933766
2-(quinoxalin-6-ylcarbamoylamino)propanoic acid
CID 4974593
2-(azetidin-3-ylidene)-N-quinoxalin-6-ylpropanamide
CID 116675974
(2S)-2-amino-4-methyl-N-quinoxalin-6-ylpentanamide
CID 61179769
2,3-difluoro-N-quinoxalin-6-ylpyridine-4-carboxamide
CID 105380445
(2R)-2-amino-3,3-dimethyl-N-quinoxalin-6-ylbutanamide
CID 103929010
4-bromo-2-fluoro-N-quinoxalin-6-ylbenzamide
CID 60811844
3-(ethylamino)-N-quinoxalin-6-ylbutanamide
CID 62839375
5-amino-4-methyl-N-quinoxalin-6-ylpentanamide
CID 82011452
N'-(1,1-difluoro-4-hydroxybutan-2-yl)-N'-methyl-N-quinolin-6-yloxamide
CID 166299903
3,3-dimethyl-N-quinoxalin-6-ylbutanamide
CID 47254889
3-amino-2,2,3-trimethyl-N-quinoxalin-6-ylbutanamide
CID 65269314

Frequently Asked Questions

What is the IUPAC name of N'-methyl-N'-propan-2-yl-N-quinoxalin-6-yloxamide?
The IUPAC name of N'-methyl-N'-propan-2-yl-N-quinoxalin-6-yloxamide (CID 99716975) is N'-methyl-N'-propan-2-yl-N-quinoxalin-6-yloxamide.
What is the SMILES notation for N'-methyl-N'-propan-2-yl-N-quinoxalin-6-yloxamide?
The canonical SMILES for N'-methyl-N'-propan-2-yl-N-quinoxalin-6-yloxamide is CC(C)N(C)C(=O)C(=O)Nc1ccc2nccnc2c1.
What is the InChIKey of N'-methyl-N'-propan-2-yl-N-quinoxalin-6-yloxamide?
The InChIKey is CZMHZPBVRVGBPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O2/c1-9(2)18(3)14(20)13(19)17-10-4-5-11-12(8-10)16-7-6-15-11/h4-9H,1-3H3,(H,17,19).
What are the key properties of N'-methyl-N'-propan-2-yl-N-quinoxalin-6-yloxamide?
N'-methyl-N'-propan-2-yl-N-quinoxalin-6-yloxamide has a molecular weight of 272.31 g/mol, XLogP of 1.44, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N'-propan-2-yl-N-quinoxalin-6-yloxamide is sourced from PubChem (CID 99716975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).