2-(3,4-dimethoxyphenyl)-N,N-bis(prop-2-enyl)quinoline-4-carboxamide

C24H24N2O3 — CID 3494981

IUPAC2-(3,4-dimethoxyphenyl)-N,N-bis(prop-2-enyl)quinoline-4-carboxamide
SMILESC=CCN(CC=C)C(=O)c1cc(-c2ccc(OC)c(OC)c2)nc2ccccc12
InChIInChI=1S/C24H24N2O3/c1-5-13-26(14-6-2)24(27)19-16-21(25-20-10-8-7-9-18(19)20)17-11-12-22(28-3)23(15-17)29-4/h5-12,15-16H,1-2,13-14H2,3-4H3
InChIKeyKMLJXKAQKVRPQK-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.73
Rot. Bonds8

About 2-(3,4-dimethoxyphenyl)-N,N-bis(prop-2-enyl)quinoline-4-carboxamide

2-(3,4-dimethoxyphenyl)-N,N-bis(prop-2-enyl)quinoline-4-carboxamide (PubChem CID 3494981) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is 2-(3,4-dimethoxyphenyl)-N,N-bis(prop-2-enyl)quinoline-4-carboxamide.

Molecular Properties

Compound Name2-(3,4-dimethoxyphenyl)-N,N-bis(prop-2-enyl)quinoline-4-carboxamide
PubChem CID3494981
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC Name2-(3,4-dimethoxyphenyl)-N,N-bis(prop-2-enyl)quinoline-4-carboxamide
SMILESC=CCN(CC=C)C(=O)c1cc(-c2ccc(OC)c(OC)c2)nc2ccccc12
InChIInChI=1S/C24H24N2O3/c1-5-13-26(14-6-2)24(27)19-16-21(25-20-10-8-7-9-18(19)20)17-11-12-22(28-3)23(15-17)29-4/h5-12,15-16H,1-2,13-14H2,3-4H3
InChIKeyKMLJXKAQKVRPQK-UHFFFAOYSA-N
XLogP4.73
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(3-bromophenyl)-N,N-bis(prop-2-enyl)quinoline-4-carboxamide
CID 3423511
2-(3,4-dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylquinoline-4-carboxamide
CID 26826456
2-(3,4-dimethoxyphenyl)-N-[(2,4-dimethylphenyl)methyl]-N-methylquinoline-4-carboxamide
CID 18267213
[(2R)-1-amino-1-oxopropan-2-yl] 2-(3,4-dimethoxyphenyl)quinoline-4-carboxylate
CID 7417732
[2-(3,4-dimethoxyphenyl)-2-oxoethyl] 2-(3,4-dimethoxyphenyl)quinoline-4-carboxylate
CID 16530903
N-prop-2-enyl-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide
CID 31012307
2-(3,4-dimethoxyphenyl)-N-naphthalen-1-ylquinoline-4-carboxamide
CID 3253298
2-(3,4-dimethoxyphenyl)-N'-(2,5-dimethylfuran-3-carbonyl)quinoline-4-carbohydrazide
CID 29169171
2-(3,4-dimethoxyphenyl)-N-octylquinoline-4-carboxamide
CID 3664969
[2-(3,4-dimethoxyphenyl)quinolin-4-yl] hydrogen carbonate
CID 70367689
[2-oxo-2-(3-phenylpropylamino)ethyl] 2-(3,4-dimethoxyphenyl)quinoline-4-carboxylate
CID 2093536
2-(3,4-dimethoxyphenyl)-N-(4-methoxyphenyl)quinoline-4-carboxamide
CID 4557332

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethoxyphenyl)-N,N-bis(prop-2-enyl)quinoline-4-carboxamide?
The IUPAC name of 2-(3,4-dimethoxyphenyl)-N,N-bis(prop-2-enyl)quinoline-4-carboxamide (CID 3494981) is 2-(3,4-dimethoxyphenyl)-N,N-bis(prop-2-enyl)quinoline-4-carboxamide.
What is the SMILES notation for 2-(3,4-dimethoxyphenyl)-N,N-bis(prop-2-enyl)quinoline-4-carboxamide?
The canonical SMILES for 2-(3,4-dimethoxyphenyl)-N,N-bis(prop-2-enyl)quinoline-4-carboxamide is C=CCN(CC=C)C(=O)c1cc(-c2ccc(OC)c(OC)c2)nc2ccccc12.
What is the InChIKey of 2-(3,4-dimethoxyphenyl)-N,N-bis(prop-2-enyl)quinoline-4-carboxamide?
The InChIKey is KMLJXKAQKVRPQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-5-13-26(14-6-2)24(27)19-16-21(25-20-10-8-7-9-18(19)20)17-11-12-22(28-3)23(15-17)29-4/h5-12,15-16H,1-2,13-14H2,3-4H3.
What are the key properties of 2-(3,4-dimethoxyphenyl)-N,N-bis(prop-2-enyl)quinoline-4-carboxamide?
2-(3,4-dimethoxyphenyl)-N,N-bis(prop-2-enyl)quinoline-4-carboxamide has a molecular weight of 388.47 g/mol, XLogP of 4.73, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethoxyphenyl)-N,N-bis(prop-2-enyl)quinoline-4-carboxamide is sourced from PubChem (CID 3494981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).