N-[4-(2-imidazol-1-ylethoxy)phenyl]-2,7-dimethylquinoline-3-carboxamide

C23H22N4O2 — CID 166198748

IUPACN-[4-(2-imidazol-1-ylethoxy)phenyl]-2,7-dimethylquinoline-3-carboxamide
SMILESCc1ccc2cc(C(=O)Nc3ccc(OCCn4ccnc4)cc3)c(C)nc2c1
InChIInChI=1S/C23H22N4O2/c1-16-3-4-18-14-21(17(2)25-22(18)13-16)23(28)26-19-5-7-20(8-6-19)29-12-11-27-10-9-24-15-27/h3-10,13-15H,11-12H2,1-2H3,(H,26,28)
InChIKeyUVYCFZNBAOMXET-UHFFFAOYSA-N
MW386.46 g/mol
LogP4.38
Rot. Bonds6

About N-[4-(2-imidazol-1-ylethoxy)phenyl]-2,7-dimethylquinoline-3-carboxamide

N-[4-(2-imidazol-1-ylethoxy)phenyl]-2,7-dimethylquinoline-3-carboxamide (PubChem CID 166198748) has the molecular formula C23H22N4O2 and a molecular weight of 386.46 g/mol. Its IUPAC name is N-[4-(2-imidazol-1-ylethoxy)phenyl]-2,7-dimethylquinoline-3-carboxamide.

Molecular Properties

Compound NameN-[4-(2-imidazol-1-ylethoxy)phenyl]-2,7-dimethylquinoline-3-carboxamide
PubChem CID166198748
Molecular FormulaC23H22N4O2
Molecular Weight386.46 g/mol
Exact Mass386.17
IUPAC NameN-[4-(2-imidazol-1-ylethoxy)phenyl]-2,7-dimethylquinoline-3-carboxamide
SMILESCc1ccc2cc(C(=O)Nc3ccc(OCCn4ccnc4)cc3)c(C)nc2c1
InChIInChI=1S/C23H22N4O2/c1-16-3-4-18-14-21(17(2)25-22(18)13-16)23(28)26-19-5-7-20(8-6-19)29-12-11-27-10-9-24-15-27/h3-10,13-15H,11-12H2,1-2H3,(H,26,28)
InChIKeyUVYCFZNBAOMXET-UHFFFAOYSA-N
XLogP4.38
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.46
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[4-(2-imidazol-1-ylethoxy)phenyl]-2,7-dimethylquinoline-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,6-dimethyl-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]quinoline-3-carboxamide
CID 55880971
N-[4-(2-imidazol-1-ylethoxy)phenyl]-3-(2-methyl-1,3-thiazol-4-yl)benzamide
CID 166233055
N-[3-(2-imidazol-1-ylethoxy)phenyl]-2-methoxybenzamide
CID 47045466
N-(4-methoxyphenyl)-2,6-dimethylquinoline-3-carboxamide
CID 34742642
1-[2-(4-methoxyphenoxy)ethyl]imidazole
CID 868397
N-[4-(2-amino-2-oxoethyl)phenyl]-7-methoxy-2-methylquinoline-3-carboxamide
CID 31859590
N-[(2S)-1-imidazol-1-ylpropan-2-yl]-2,6-dimethylquinoline-3-carboxamide
CID 94448585
N-[4-(diethylcarbamoyl)phenyl]-7-methoxy-2-methylquinoline-3-carboxamide
CID 17488486
2,7-dimethyl-N-(6-piperidin-1-yl-3-pyridinyl)quinoline-3-carboxamide
CID 55651955
7-methoxy-2-methyl-N-[4-(4-methylphenoxy)butyl]quinoline-3-carboxamide
CID 55868189
N-[4-(5-imidazol-1-ylpentoxy)phenyl]pyridine-3-carboxamide
CID 13219174
N-[4-(difluoromethoxy)phenyl]-7-fluoro-2-methylquinoline-3-carboxamide
CID 46520644

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-imidazol-1-ylethoxy)phenyl]-2,7-dimethylquinoline-3-carboxamide?
The IUPAC name of N-[4-(2-imidazol-1-ylethoxy)phenyl]-2,7-dimethylquinoline-3-carboxamide (CID 166198748) is N-[4-(2-imidazol-1-ylethoxy)phenyl]-2,7-dimethylquinoline-3-carboxamide.
What is the SMILES notation for N-[4-(2-imidazol-1-ylethoxy)phenyl]-2,7-dimethylquinoline-3-carboxamide?
The canonical SMILES for N-[4-(2-imidazol-1-ylethoxy)phenyl]-2,7-dimethylquinoline-3-carboxamide is Cc1ccc2cc(C(=O)Nc3ccc(OCCn4ccnc4)cc3)c(C)nc2c1.
What is the InChIKey of N-[4-(2-imidazol-1-ylethoxy)phenyl]-2,7-dimethylquinoline-3-carboxamide?
The InChIKey is UVYCFZNBAOMXET-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O2/c1-16-3-4-18-14-21(17(2)25-22(18)13-16)23(28)26-19-5-7-20(8-6-19)29-12-11-27-10-9-24-15-27/h3-10,13-15H,11-12H2,1-2H3,(H,26,28).
What are the key properties of N-[4-(2-imidazol-1-ylethoxy)phenyl]-2,7-dimethylquinoline-3-carboxamide?
N-[4-(2-imidazol-1-ylethoxy)phenyl]-2,7-dimethylquinoline-3-carboxamide has a molecular weight of 386.46 g/mol, XLogP of 4.38, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-imidazol-1-ylethoxy)phenyl]-2,7-dimethylquinoline-3-carboxamide is sourced from PubChem (CID 166198748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).