N-(2,4-dimethoxyphenyl)phenazine-1-carboxamide

C21H17N3O3 — CID 16824395

IUPACN-(2,4-dimethoxyphenyl)phenazine-1-carboxamide
SMILESCOc1ccc(NC(=O)c2cccc3nc4ccccc4nc23)c(OC)c1
InChIInChI=1S/C21H17N3O3/c1-26-13-10-11-17(19(12-13)27-2)24-21(25)14-6-5-9-18-20(14)23-16-8-4-3-7-15(16)22-18/h3-12H,1-2H3,(H,24,25)
InChIKeyDZOWZBBYDQTMQM-UHFFFAOYSA-N
MW359.39 g/mol
LogP4.05
Rot. Bonds4

About N-(2,4-dimethoxyphenyl)phenazine-1-carboxamide

N-(2,4-dimethoxyphenyl)phenazine-1-carboxamide (PubChem CID 16824395) has the molecular formula C21H17N3O3 and a molecular weight of 359.39 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)phenazine-1-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)phenazine-1-carboxamide
PubChem CID16824395
Molecular FormulaC21H17N3O3
Molecular Weight359.39 g/mol
Exact Mass359.13
IUPAC NameN-(2,4-dimethoxyphenyl)phenazine-1-carboxamide
SMILESCOc1ccc(NC(=O)c2cccc3nc4ccccc4nc23)c(OC)c1
InChIInChI=1S/C21H17N3O3/c1-26-13-10-11-17(19(12-13)27-2)24-21(25)14-6-5-9-18-20(14)23-16-8-4-3-7-15(16)22-18/h3-12H,1-2H3,(H,24,25)
InChIKeyDZOWZBBYDQTMQM-UHFFFAOYSA-N
XLogP4.05
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.39
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

N-(2,4-dimethoxyphenyl)-3-methoxyquinoxaline-2-carboxamide
CID 50780781
2-chloro-N-(2,4-dimethoxyphenyl)benzamide
CID 722324
2-amino-N-(2,4-dimethoxyphenyl)benzamide
CID 902679
N-(2,4-dimethoxyphenyl)-2-naphthalen-1-ylquinoline-4-carboxamide
CID 2353292
N-(2,4-dimethoxyphenyl)-1H-indazole-7-carboxamide
CID 36805049
2-bromo-N-(2,4-dimethoxyphenyl)-3-methylbenzamide
CID 103852740
N-(2,4-dimethoxyphenyl)-3-piperidin-1-ylquinoxaline-2-carboxamide
CID 46365183
5-chloro-N-(2,4-dimethoxyphenyl)naphthalene-1-carboxamide
CID 17101910
2-(1,3-benzothiazol-2-yl)-N-(2,4-dimethoxyphenyl)pyridine-3-carboxamide
CID 18858904
N-(2,4-dimethoxyphenyl)-2-ethylsulfonylbenzamide
CID 7603183
2-[bis(4-hydroxyphenyl)methyl]-N-(2,4-dimethoxyphenyl)benzamide
CID 15296782
N-(2,4-dimethoxyphenyl)-4-phenylbenzamide
CID 602380

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)phenazine-1-carboxamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)phenazine-1-carboxamide (CID 16824395) is N-(2,4-dimethoxyphenyl)phenazine-1-carboxamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)phenazine-1-carboxamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)phenazine-1-carboxamide is COc1ccc(NC(=O)c2cccc3nc4ccccc4nc23)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)phenazine-1-carboxamide?
The InChIKey is DZOWZBBYDQTMQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3O3/c1-26-13-10-11-17(19(12-13)27-2)24-21(25)14-6-5-9-18-20(14)23-16-8-4-3-7-15(16)22-18/h3-12H,1-2H3,(H,24,25).
What are the key properties of N-(2,4-dimethoxyphenyl)phenazine-1-carboxamide?
N-(2,4-dimethoxyphenyl)phenazine-1-carboxamide has a molecular weight of 359.39 g/mol, XLogP of 4.05, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)phenazine-1-carboxamide is sourced from PubChem (CID 16824395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).