N-[1-(dimethylamino)ethyl]acridine-4-carboxamide

C18H19N3O — CID 18688656

IUPACN-[1-(dimethylamino)ethyl]acridine-4-carboxamide
SMILESCC(NC(=O)c1cccc2cc3ccccc3nc12)N(C)C
InChIInChI=1S/C18H19N3O/c1-12(21(2)3)19-18(22)15-9-6-8-14-11-13-7-4-5-10-16(13)20-17(14)15/h4-12H,1-3H3,(H,19,22)
InChIKeyRRWQIEZPCZIYKP-UHFFFAOYSA-N
MW293.37 g/mol
LogP3.03
Rot. Bonds3

About N-[1-(dimethylamino)ethyl]acridine-4-carboxamide

N-[1-(dimethylamino)ethyl]acridine-4-carboxamide (PubChem CID 18688656) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is N-[1-(dimethylamino)ethyl]acridine-4-carboxamide.

Molecular Properties

Compound NameN-[1-(dimethylamino)ethyl]acridine-4-carboxamide
PubChem CID18688656
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC NameN-[1-(dimethylamino)ethyl]acridine-4-carboxamide
SMILESCC(NC(=O)c1cccc2cc3ccccc3nc12)N(C)C
InChIInChI=1S/C18H19N3O/c1-12(21(2)3)19-18(22)15-9-6-8-14-11-13-7-4-5-10-16(13)20-17(14)15/h4-12H,1-3H3,(H,19,22)
InChIKeyRRWQIEZPCZIYKP-UHFFFAOYSA-N
XLogP3.03
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

acridine-4-carboxamide
CID 3025721
N-(4-hydroxybutyl)acridine-4-carboxamide
CID 11033729
2-(acridine-4-carbonylamino)ethyl-hydroxy-dimethylazanium;dihydrochloride
CID 21143217
N-[1-(dimethylamino)ethyl]-6-methyl-1-oxo-2H-benzo[b][1,6]naphthyridine-4-carboxamide
CID 87135372
4-propan-2-ylacridine
CID 87209750
N-[2-(dimethylamino)ethyl]-6,7-dimethylacridine-4-carboxamide
CID 54432311
N-[2-(dimethylamino)ethyl]-5-phenylacridine-4-carboxamide
CID 10690459
N-(1-phenylethyl)quinoline-8-carboxamide
CID 51180563
N-[2-(dimethylamino)ethyl]-7-(trifluoromethyl)acridine-4-carboxamide
CID 11792926
8-(chloromethyl)-N-[3-[3-[[8-(chloromethyl)acridine-4-carbonyl]amino]propyl-methylamino]propyl]acridine-4-carboxamide
CID 54093592
N-methylacridin-4-amine;N-phenylbenzamide
CID 174981104
N-methylphenazine-1-carboxamide
CID 4257706

Frequently Asked Questions

What is the IUPAC name of N-[1-(dimethylamino)ethyl]acridine-4-carboxamide?
The IUPAC name of N-[1-(dimethylamino)ethyl]acridine-4-carboxamide (CID 18688656) is N-[1-(dimethylamino)ethyl]acridine-4-carboxamide.
What is the SMILES notation for N-[1-(dimethylamino)ethyl]acridine-4-carboxamide?
The canonical SMILES for N-[1-(dimethylamino)ethyl]acridine-4-carboxamide is CC(NC(=O)c1cccc2cc3ccccc3nc12)N(C)C.
What is the InChIKey of N-[1-(dimethylamino)ethyl]acridine-4-carboxamide?
The InChIKey is RRWQIEZPCZIYKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O/c1-12(21(2)3)19-18(22)15-9-6-8-14-11-13-7-4-5-10-16(13)20-17(14)15/h4-12H,1-3H3,(H,19,22).
What are the key properties of N-[1-(dimethylamino)ethyl]acridine-4-carboxamide?
N-[1-(dimethylamino)ethyl]acridine-4-carboxamide has a molecular weight of 293.37 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(dimethylamino)ethyl]acridine-4-carboxamide is sourced from PubChem (CID 18688656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).