2-(ethylamino)-N-(4-morpholin-4-ylphenyl)quinoline-4-carboxamide

C22H24N4O2 — CID 117089575

IUPAC2-(ethylamino)-N-(4-morpholin-4-ylphenyl)quinoline-4-carboxamide
SMILESCCNc1cc(C(=O)Nc2ccc(N3CCOCC3)cc2)c2ccccc2n1
InChIInChI=1S/C22H24N4O2/c1-2-23-21-15-19(18-5-3-4-6-20(18)25-21)22(27)24-16-7-9-17(10-8-16)26-11-13-28-14-12-26/h3-10,15H,2,11-14H2,1H3,(H,23,25)(H,24,27)
InChIKeyANXUOMBNCPHESV-UHFFFAOYSA-N
MW376.46 g/mol
LogP3.76
Rot. Bonds5

About 2-(ethylamino)-N-(4-morpholin-4-ylphenyl)quinoline-4-carboxamide

2-(ethylamino)-N-(4-morpholin-4-ylphenyl)quinoline-4-carboxamide (PubChem CID 117089575) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is 2-(ethylamino)-N-(4-morpholin-4-ylphenyl)quinoline-4-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-N-(4-morpholin-4-ylphenyl)quinoline-4-carboxamide
PubChem CID117089575
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC Name2-(ethylamino)-N-(4-morpholin-4-ylphenyl)quinoline-4-carboxamide
SMILESCCNc1cc(C(=O)Nc2ccc(N3CCOCC3)cc2)c2ccccc2n1
InChIInChI=1S/C22H24N4O2/c1-2-23-21-15-19(18-5-3-4-6-20(18)25-21)22(27)24-16-7-9-17(10-8-16)26-11-13-28-14-12-26/h3-10,15H,2,11-14H2,1H3,(H,23,25)(H,24,27)
InChIKeyANXUOMBNCPHESV-UHFFFAOYSA-N
XLogP3.76
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

N-(4-methylphenyl)-2-morpholin-4-ylquinoline-4-carboxamide
CID 659672
N-cyclopropyl-2-(4-morpholin-4-ylanilino)quinoline-4-carboxamide
CID 117090375
6-fluoro-2-methyl-N-(4-morpholin-4-ylphenyl)quinoline-4-carboxamide
CID 108802559
2-(4-morpholin-4-ylanilino)-N-[3-(2-oxopyrrolidin-1-yl)propyl]quinoline-4-carboxamide
CID 117089914
2-(ethylamino)-N-(2-methylbutan-2-yl)quinoline-4-carboxamide
CID 62173209
[2-(4-morpholin-4-ylanilino)-2-oxoethyl] 2-phenylquinoline-4-carboxylate
CID 2358673
N-(4-morpholin-4-ylphenyl)-2-(2-propylquinazolin-4-yl)sulfanylacetamide
CID 1442655
2-(ethylamino)-N-(1H-imidazol-2-yl)quinoline-4-carboxamide
CID 63563758
N-(4-morpholin-4-ylphenyl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
CID 8961124
2-(ethylamino)-N-pentan-2-ylquinoline-4-carboxamide
CID 62185765
2-fluoro-N-(4-morpholin-4-ylphenyl)benzamide
CID 781635
2-bromo-N-(4-morpholin-4-ylphenyl)benzamide
CID 1181771

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-(4-morpholin-4-ylphenyl)quinoline-4-carboxamide?
The IUPAC name of 2-(ethylamino)-N-(4-morpholin-4-ylphenyl)quinoline-4-carboxamide (CID 117089575) is 2-(ethylamino)-N-(4-morpholin-4-ylphenyl)quinoline-4-carboxamide.
What is the SMILES notation for 2-(ethylamino)-N-(4-morpholin-4-ylphenyl)quinoline-4-carboxamide?
The canonical SMILES for 2-(ethylamino)-N-(4-morpholin-4-ylphenyl)quinoline-4-carboxamide is CCNc1cc(C(=O)Nc2ccc(N3CCOCC3)cc2)c2ccccc2n1.
What is the InChIKey of 2-(ethylamino)-N-(4-morpholin-4-ylphenyl)quinoline-4-carboxamide?
The InChIKey is ANXUOMBNCPHESV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-2-23-21-15-19(18-5-3-4-6-20(18)25-21)22(27)24-16-7-9-17(10-8-16)26-11-13-28-14-12-26/h3-10,15H,2,11-14H2,1H3,(H,23,25)(H,24,27).
What are the key properties of 2-(ethylamino)-N-(4-morpholin-4-ylphenyl)quinoline-4-carboxamide?
2-(ethylamino)-N-(4-morpholin-4-ylphenyl)quinoline-4-carboxamide has a molecular weight of 376.46 g/mol, XLogP of 3.76, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-(4-morpholin-4-ylphenyl)quinoline-4-carboxamide is sourced from PubChem (CID 117089575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).