N-[1-(dimethylamino)propan-2-yl]-4-methoxybenzo[a]phenazine-11-carboxamide

C23H24N4O2 — CID 11090378

IUPACN-[1-(dimethylamino)propan-2-yl]-4-methoxybenzo[a]phenazine-11-carboxamide
SMILESCOc1cccc2c1ccc1nc3cccc(C(=O)NC(C)CN(C)C)c3nc12
InChIInChI=1S/C23H24N4O2/c1-14(13-27(2)3)24-23(28)17-8-5-9-18-22(17)26-21-16-7-6-10-20(29-4)15(16)11-12-19(21)25-18/h5-12,14H,13H2,1-4H3,(H,24,28)
InChIKeyACAXGYADTLFREX-UHFFFAOYSA-N
MW388.47 g/mol
LogP3.62
Rot. Bonds5

About N-[1-(dimethylamino)propan-2-yl]-4-methoxybenzo[a]phenazine-11-carboxamide

N-[1-(dimethylamino)propan-2-yl]-4-methoxybenzo[a]phenazine-11-carboxamide (PubChem CID 11090378) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is N-[1-(dimethylamino)propan-2-yl]-4-methoxybenzo[a]phenazine-11-carboxamide.

Molecular Properties

Compound NameN-[1-(dimethylamino)propan-2-yl]-4-methoxybenzo[a]phenazine-11-carboxamide
PubChem CID11090378
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC NameN-[1-(dimethylamino)propan-2-yl]-4-methoxybenzo[a]phenazine-11-carboxamide
SMILESCOc1cccc2c1ccc1nc3cccc(C(=O)NC(C)CN(C)C)c3nc12
InChIInChI=1S/C23H24N4O2/c1-14(13-27(2)3)24-23(28)17-8-5-9-18-22(17)26-21-16-7-6-10-20(29-4)15(16)11-12-19(21)25-18/h5-12,14H,13H2,1-4H3,(H,24,28)
InChIKeyACAXGYADTLFREX-UHFFFAOYSA-N
XLogP3.62
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het_6666_A(2)', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze N-[1-(dimethylamino)propan-2-yl]-4-methoxybenzo[a]phenazine-11-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[1-(dimethylamino)propan-2-yl]-4-methoxybenzo[a]phenazine-11-carboxamide?
The IUPAC name of N-[1-(dimethylamino)propan-2-yl]-4-methoxybenzo[a]phenazine-11-carboxamide (CID 11090378) is N-[1-(dimethylamino)propan-2-yl]-4-methoxybenzo[a]phenazine-11-carboxamide.
What is the SMILES notation for N-[1-(dimethylamino)propan-2-yl]-4-methoxybenzo[a]phenazine-11-carboxamide?
The canonical SMILES for N-[1-(dimethylamino)propan-2-yl]-4-methoxybenzo[a]phenazine-11-carboxamide is COc1cccc2c1ccc1nc3cccc(C(=O)NC(C)CN(C)C)c3nc12.
What is the InChIKey of N-[1-(dimethylamino)propan-2-yl]-4-methoxybenzo[a]phenazine-11-carboxamide?
The InChIKey is ACAXGYADTLFREX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2/c1-14(13-27(2)3)24-23(28)17-8-5-9-18-22(17)26-21-16-7-6-10-20(29-4)15(16)11-12-19(21)25-18/h5-12,14H,13H2,1-4H3,(H,24,28).
What are the key properties of N-[1-(dimethylamino)propan-2-yl]-4-methoxybenzo[a]phenazine-11-carboxamide?
N-[1-(dimethylamino)propan-2-yl]-4-methoxybenzo[a]phenazine-11-carboxamide has a molecular weight of 388.47 g/mol, XLogP of 3.62, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(dimethylamino)propan-2-yl]-4-methoxybenzo[a]phenazine-11-carboxamide is sourced from PubChem (CID 11090378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).