N-[2-(dimethylamino)ethyl]-4-methoxypyrido[2,3-a]phenazine-11-carboxamide

C21H21N5O2 — CID 10199480

IUPACN-[2-(dimethylamino)ethyl]-4-methoxypyrido[2,3-a]phenazine-11-carboxamide
SMILESCOc1ccnc2c1ccc1nc3cccc(C(=O)NCCN(C)C)c3nc12
InChIInChI=1S/C21H21N5O2/c1-26(2)12-11-23-21(27)14-5-4-6-15-18(14)25-20-16(24-15)8-7-13-17(28-3)9-10-22-19(13)20/h4-10H,11-12H2,1-3H3,(H,23,27)
InChIKeyFHUZDSAWNBLTFZ-UHFFFAOYSA-N
MW375.43 g/mol
LogP2.63
Rot. Bonds5

About N-[2-(dimethylamino)ethyl]-4-methoxypyrido[2,3-a]phenazine-11-carboxamide

N-[2-(dimethylamino)ethyl]-4-methoxypyrido[2,3-a]phenazine-11-carboxamide (PubChem CID 10199480) has the molecular formula C21H21N5O2 and a molecular weight of 375.43 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-4-methoxypyrido[2,3-a]phenazine-11-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-4-methoxypyrido[2,3-a]phenazine-11-carboxamide
PubChem CID10199480
Molecular FormulaC21H21N5O2
Molecular Weight375.43 g/mol
Exact Mass375.17
IUPAC NameN-[2-(dimethylamino)ethyl]-4-methoxypyrido[2,3-a]phenazine-11-carboxamide
SMILESCOc1ccnc2c1ccc1nc3cccc(C(=O)NCCN(C)C)c3nc12
InChIInChI=1S/C21H21N5O2/c1-26(2)12-11-23-21(27)14-5-4-6-15-18(14)25-20-16(24-15)8-7-13-17(28-3)9-10-22-19(13)20/h4-10H,11-12H2,1-3H3,(H,23,27)
InChIKeyFHUZDSAWNBLTFZ-UHFFFAOYSA-N
XLogP2.63
TPSA80.24 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.43
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-4-methoxypyrido[2,3-a]phenazine-11-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-4-methoxypyrido[2,3-a]phenazine-11-carboxamide (CID 10199480) is N-[2-(dimethylamino)ethyl]-4-methoxypyrido[2,3-a]phenazine-11-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-4-methoxypyrido[2,3-a]phenazine-11-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-4-methoxypyrido[2,3-a]phenazine-11-carboxamide is COc1ccnc2c1ccc1nc3cccc(C(=O)NCCN(C)C)c3nc12.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-4-methoxypyrido[2,3-a]phenazine-11-carboxamide?
The InChIKey is FHUZDSAWNBLTFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N5O2/c1-26(2)12-11-23-21(27)14-5-4-6-15-18(14)25-20-16(24-15)8-7-13-17(28-3)9-10-22-19(13)20/h4-10H,11-12H2,1-3H3,(H,23,27).
What are the key properties of N-[2-(dimethylamino)ethyl]-4-methoxypyrido[2,3-a]phenazine-11-carboxamide?
N-[2-(dimethylamino)ethyl]-4-methoxypyrido[2,3-a]phenazine-11-carboxamide has a molecular weight of 375.43 g/mol, XLogP of 2.63, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-4-methoxypyrido[2,3-a]phenazine-11-carboxamide is sourced from PubChem (CID 10199480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).