N,N-diethyl-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide

C22H24N2O2 — CID 4199357

IUPACN,N-diethyl-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide
SMILESCCN(CC)C(=O)c1c(C)c(-c2ccc(OC)cc2)nc2ccccc12
InChIInChI=1S/C22H24N2O2/c1-5-24(6-2)22(25)20-15(3)21(16-11-13-17(26-4)14-12-16)23-19-10-8-7-9-18(19)20/h7-14H,5-6H2,1-4H3
InChIKeyFVKIDGJDUUFXRH-UHFFFAOYSA-N
MW348.45 g/mol
LogP4.70
Rot. Bonds5

About N,N-diethyl-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide

N,N-diethyl-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide (PubChem CID 4199357) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is N,N-diethyl-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide
PubChem CID4199357
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC NameN,N-diethyl-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide
SMILESCCN(CC)C(=O)c1c(C)c(-c2ccc(OC)cc2)nc2ccccc12
InChIInChI=1S/C22H24N2O2/c1-5-24(6-2)22(25)20-15(3)21(16-11-13-17(26-4)14-12-16)23-19-10-8-7-9-18(19)20/h7-14H,5-6H2,1-4H3
InChIKeyFVKIDGJDUUFXRH-UHFFFAOYSA-N
XLogP4.70
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dicyclohexyl-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide
CID 3348119
2-(4-methoxyphenyl)-3-methyl-N-(2-phenylethyl)quinoline-4-carboxamide
CID 5197457
2-(4-methoxyphenyl)-3-methyl-N-propan-2-ylquinoline-4-carboxamide
CID 896971
N-(2,6-diethylphenyl)-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide
CID 3681950
2-(4-methoxyphenyl)-3-methyl-N-naphthalen-2-ylquinoline-4-carboxamide
CID 4115326
N-(4-butylphenyl)-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide
CID 4608973
2-(4-methoxyphenyl)-3,4-dimethylquinoline;hydrochloride
CID 42918992
2,3-bis(4-methoxyphenyl)quinoline-4-carboxylic acid
CID 95560580
N,N-diethyl-2,4-dimethylquinoline-3-carboxamide
CID 10824990
ethyl 5-(diethylcarbamoyl)-4-methyl-2-[(3-methyl-2-phenylquinoline-4-carbonyl)amino]thiophene-3-carboxylate
CID 4148218
N,N-diethyl-3-methoxyquinoline-4-carboxamide
CID 110855209
2-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)quinoline-4-carboxamide
CID 1220212

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide?
The IUPAC name of N,N-diethyl-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide (CID 4199357) is N,N-diethyl-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide.
What is the SMILES notation for N,N-diethyl-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide?
The canonical SMILES for N,N-diethyl-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide is CCN(CC)C(=O)c1c(C)c(-c2ccc(OC)cc2)nc2ccccc12.
What is the InChIKey of N,N-diethyl-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide?
The InChIKey is FVKIDGJDUUFXRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O2/c1-5-24(6-2)22(25)20-15(3)21(16-11-13-17(26-4)14-12-16)23-19-10-8-7-9-18(19)20/h7-14H,5-6H2,1-4H3.
What are the key properties of N,N-diethyl-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide?
N,N-diethyl-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide has a molecular weight of 348.45 g/mol, XLogP of 4.70, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide is sourced from PubChem (CID 4199357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).