N-[(2-methoxyphenyl)methyl]quinoxaline-5-carboxamide

C17H15N3O2 — CID 110701357

IUPACN-[(2-methoxyphenyl)methyl]quinoxaline-5-carboxamide
SMILESCOc1ccccc1CNC(=O)c1cccc2nccnc12
InChIInChI=1S/C17H15N3O2/c1-22-15-8-3-2-5-12(15)11-20-17(21)13-6-4-7-14-16(13)19-10-9-18-14/h2-10H,11H2,1H3,(H,20,21)
InChIKeyWEFFDCWPIMQIDO-UHFFFAOYSA-N
MW293.33 g/mol
LogP2.57
Rot. Bonds4

About N-[(2-methoxyphenyl)methyl]quinoxaline-5-carboxamide

N-[(2-methoxyphenyl)methyl]quinoxaline-5-carboxamide (PubChem CID 110701357) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]quinoxaline-5-carboxamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]quinoxaline-5-carboxamide
PubChem CID110701357
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC NameN-[(2-methoxyphenyl)methyl]quinoxaline-5-carboxamide
SMILESCOc1ccccc1CNC(=O)c1cccc2nccnc12
InChIInChI=1S/C17H15N3O2/c1-22-15-8-3-2-5-12(15)11-20-17(21)13-6-4-7-14-16(13)19-10-9-18-14/h2-10H,11H2,1H3,(H,20,21)
InChIKeyWEFFDCWPIMQIDO-UHFFFAOYSA-N
XLogP2.57
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-dimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 912335
N-[(4-methoxyphenyl)methyl]quinoxaline-5-carboxamide
CID 110701358
3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide
CID 82786350
N-(cyanomethyl)quinoxaline-5-carboxamide
CID 104580010
2-iodo-N-[(2-methoxyphenyl)methyl]benzamide
CID 1378811
N-[(4-fluorophenyl)methyl]quinoxaline-5-carboxamide
CID 110701354
2-(difluoromethoxy)-3-methoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 51143674
[2-[(2-methoxyphenyl)methylcarbamoyl]phenyl] acetate
CID 3362065
2,4,5-trimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 912738
4-methoxy-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzamide
CID 110761590
N-[(2-methoxyphenyl)methyl]-2-methylsulfonylbenzamide
CID 18081414
N-[(2,3-dimethoxyphenyl)methyl]naphthalene-1-carboxamide
CID 46590604

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]quinoxaline-5-carboxamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]quinoxaline-5-carboxamide (CID 110701357) is N-[(2-methoxyphenyl)methyl]quinoxaline-5-carboxamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]quinoxaline-5-carboxamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]quinoxaline-5-carboxamide is COc1ccccc1CNC(=O)c1cccc2nccnc12.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]quinoxaline-5-carboxamide?
The InChIKey is WEFFDCWPIMQIDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c1-22-15-8-3-2-5-12(15)11-20-17(21)13-6-4-7-14-16(13)19-10-9-18-14/h2-10H,11H2,1H3,(H,20,21).
What are the key properties of N-[(2-methoxyphenyl)methyl]quinoxaline-5-carboxamide?
N-[(2-methoxyphenyl)methyl]quinoxaline-5-carboxamide has a molecular weight of 293.33 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]quinoxaline-5-carboxamide is sourced from PubChem (CID 110701357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).