4-(diethylamino)-N-quinolin-5-ylbenzamide

C20H21N3O — CID 112767915

IUPAC4-(diethylamino)-N-quinolin-5-ylbenzamide
SMILESCCN(CC)c1ccc(C(=O)Nc2cccc3ncccc23)cc1
InChIInChI=1S/C20H21N3O/c1-3-23(4-2)16-12-10-15(11-13-16)20(24)22-19-9-5-8-18-17(19)7-6-14-21-18/h5-14H,3-4H2,1-2H3,(H,22,24)
InChIKeyIYDABECTQBQRIM-UHFFFAOYSA-N
MW319.41 g/mol
LogP4.33
Rot. Bonds5

About 4-(diethylamino)-N-quinolin-5-ylbenzamide

4-(diethylamino)-N-quinolin-5-ylbenzamide (PubChem CID 112767915) has the molecular formula C20H21N3O and a molecular weight of 319.41 g/mol. Its IUPAC name is 4-(diethylamino)-N-quinolin-5-ylbenzamide.

Molecular Properties

Compound Name4-(diethylamino)-N-quinolin-5-ylbenzamide
PubChem CID112767915
Molecular FormulaC20H21N3O
Molecular Weight319.41 g/mol
Exact Mass319.17
IUPAC Name4-(diethylamino)-N-quinolin-5-ylbenzamide
SMILESCCN(CC)c1ccc(C(=O)Nc2cccc3ncccc23)cc1
InChIInChI=1S/C20H21N3O/c1-3-23(4-2)16-12-10-15(11-13-16)20(24)22-19-9-5-8-18-17(19)7-6-14-21-18/h5-14H,3-4H2,1-2H3,(H,22,24)
InChIKeyIYDABECTQBQRIM-UHFFFAOYSA-N
XLogP4.33
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(methylamino)-N-quinolin-5-ylbenzamide
CID 62187273
4-butoxy-N-quinolin-5-ylbenzamide
CID 3982301
4-(bromomethyl)-N-quinolin-5-ylbenzamide
CID 102850797
4-methylsulfinyl-N-quinolin-5-ylbenzamide
CID 51182481
2,3-dimethyl-N-quinolin-5-ylquinoxaline-6-carboxamide
CID 51205597
2,6-dichloro-N-quinolin-5-ylpyridine-4-carboxamide
CID 2782162
3-chloro-N-quinolin-5-ylbenzamide
CID 5127132
N-quinolin-5-ylpyridine-2-carboxamide
CID 3985423
4-[(1-methylimidazol-2-yl)methoxy]-N-quinolin-5-ylbenzamide
CID 55736145
2-bromo-N-quinolin-5-ylpyridine-4-carboxamide
CID 103751909
CID 73213052
CID 73213052
4-bromo-3,5-dimethoxy-N-quinolin-5-ylbenzamide
CID 26706123

Frequently Asked Questions

What is the IUPAC name of 4-(diethylamino)-N-quinolin-5-ylbenzamide?
The IUPAC name of 4-(diethylamino)-N-quinolin-5-ylbenzamide (CID 112767915) is 4-(diethylamino)-N-quinolin-5-ylbenzamide.
What is the SMILES notation for 4-(diethylamino)-N-quinolin-5-ylbenzamide?
The canonical SMILES for 4-(diethylamino)-N-quinolin-5-ylbenzamide is CCN(CC)c1ccc(C(=O)Nc2cccc3ncccc23)cc1.
What is the InChIKey of 4-(diethylamino)-N-quinolin-5-ylbenzamide?
The InChIKey is IYDABECTQBQRIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O/c1-3-23(4-2)16-12-10-15(11-13-16)20(24)22-19-9-5-8-18-17(19)7-6-14-21-18/h5-14H,3-4H2,1-2H3,(H,22,24).
What are the key properties of 4-(diethylamino)-N-quinolin-5-ylbenzamide?
4-(diethylamino)-N-quinolin-5-ylbenzamide has a molecular weight of 319.41 g/mol, XLogP of 4.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(diethylamino)-N-quinolin-5-ylbenzamide is sourced from PubChem (CID 112767915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).