N-[2-(diethylamino)ethyl]-2-phenylquinoline-4-carboxamide

C22H25N3O — CID 2322323

IUPACN-[2-(diethylamino)ethyl]-2-phenylquinoline-4-carboxamide
SMILESCCN(CC)CCNC(=O)c1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C22H25N3O/c1-3-25(4-2)15-14-23-22(26)19-16-21(17-10-6-5-7-11-17)24-20-13-9-8-12-18(19)20/h5-13,16H,3-4,14-15H2,1-2H3,(H,23,26)
InChIKeyFENHHUPSODCNBY-UHFFFAOYSA-N
MW347.46 g/mol
LogP3.97
Rot. Bonds7

About N-[2-(diethylamino)ethyl]-2-phenylquinoline-4-carboxamide

N-[2-(diethylamino)ethyl]-2-phenylquinoline-4-carboxamide (PubChem CID 2322323) has the molecular formula C22H25N3O and a molecular weight of 347.46 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]-2-phenylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]-2-phenylquinoline-4-carboxamide
PubChem CID2322323
Molecular FormulaC22H25N3O
Molecular Weight347.46 g/mol
Exact Mass347.20
IUPAC NameN-[2-(diethylamino)ethyl]-2-phenylquinoline-4-carboxamide
SMILESCCN(CC)CCNC(=O)c1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C22H25N3O/c1-3-25(4-2)15-14-23-22(26)19-16-21(17-10-6-5-7-11-17)24-20-13-9-8-12-18(19)20/h5-13,16H,3-4,14-15H2,1-2H3,(H,23,26)
InChIKeyFENHHUPSODCNBY-UHFFFAOYSA-N
XLogP3.97
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.46
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(diethylamino)ethyl]-2-(2-methoxypyrimidin-5-yl)quinoline-4-carboxamide
CID 155555807
2-chloro-N-[2-(diethylamino)ethyl]quinoline-4-carboxamide
CID 13255244
N-[2-[(2-methylbenzoyl)amino]ethyl]-2-phenylquinoline-4-carboxamide
CID 8991019
N-(2-acetamidoethyl)-2-phenylquinoline-4-carboxamide
CID 8991025
N-dodecyl-2-phenylquinoline-4-carboxamide
CID 4169141
N-[2-[bis(2-methylpropyl)amino]ethyl]-2-pyridin-4-ylquinoline-4-carboxamide
CID 4302865
N-(3-methylbutyl)-2-phenylquinoline-4-carboxamide
CID 757603
N-[2-(dimethylamino)ethyl]-2-(4-fluorophenyl)quinoline-4-carboxamide
CID 2333756
N-[2-(dimethylamino)ethyl]-2-(4-propylphenyl)quinoline-4-carboxamide
CID 1261381
N-(3-aminopropyl)-2-phenylquinoline-4-carboxamide
CID 162460245
2-(3-bromophenyl)-N-[2-(dimethylamino)ethyl]quinoline-4-carboxamide
CID 2367409
N-(3,3-diphenylpropyl)-2-phenylquinoline-4-carboxamide
CID 3975815

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]-2-phenylquinoline-4-carboxamide?
The IUPAC name of N-[2-(diethylamino)ethyl]-2-phenylquinoline-4-carboxamide (CID 2322323) is N-[2-(diethylamino)ethyl]-2-phenylquinoline-4-carboxamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]-2-phenylquinoline-4-carboxamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]-2-phenylquinoline-4-carboxamide is CCN(CC)CCNC(=O)c1cc(-c2ccccc2)nc2ccccc12.
What is the InChIKey of N-[2-(diethylamino)ethyl]-2-phenylquinoline-4-carboxamide?
The InChIKey is FENHHUPSODCNBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O/c1-3-25(4-2)15-14-23-22(26)19-16-21(17-10-6-5-7-11-17)24-20-13-9-8-12-18(19)20/h5-13,16H,3-4,14-15H2,1-2H3,(H,23,26).
What are the key properties of N-[2-(diethylamino)ethyl]-2-phenylquinoline-4-carboxamide?
N-[2-(diethylamino)ethyl]-2-phenylquinoline-4-carboxamide has a molecular weight of 347.46 g/mol, XLogP of 3.97, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]-2-phenylquinoline-4-carboxamide is sourced from PubChem (CID 2322323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).