N-[(1R)-1-(4-methoxyphenyl)ethyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide

C26H22N4O2 — CID 164628072

IUPACN-[(1R)-1-(4-methoxyphenyl)ethyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCOc1ccc([C@@H](C)NC(=O)c2cnc3ccc(-c4ccc5ncccc5c4)cn23)cc1
InChIInChI=1S/C26H22N4O2/c1-17(18-5-9-22(32-2)10-6-18)29-26(31)24-15-28-25-12-8-21(16-30(24)25)19-7-11-23-20(14-19)4-3-13-27-23/h3-17H,1-2H3,(H,29,31)/t17-/m1/s1
InChIKeyDWARRSITHQNDEU-QGZVFWFLSA-N
MW422.49 g/mol
LogP5.05
Rot. Bonds5

About N-[(1R)-1-(4-methoxyphenyl)ethyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide

N-[(1R)-1-(4-methoxyphenyl)ethyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 164628072) has the molecular formula C26H22N4O2 and a molecular weight of 422.49 g/mol. Its IUPAC name is N-[(1R)-1-(4-methoxyphenyl)ethyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-(4-methoxyphenyl)ethyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID164628072
Molecular FormulaC26H22N4O2
Molecular Weight422.49 g/mol
Exact Mass422.17
IUPAC NameN-[(1R)-1-(4-methoxyphenyl)ethyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCOc1ccc([C@@H](C)NC(=O)c2cnc3ccc(-c4ccc5ncccc5c4)cn23)cc1
InChIInChI=1S/C26H22N4O2/c1-17(18-5-9-22(32-2)10-6-18)29-26(31)24-15-28-25-12-8-21(16-30(24)25)19-7-11-23-20(14-19)4-3-13-27-23/h3-17H,1-2H3,(H,29,31)/t17-/m1/s1
InChIKeyDWARRSITHQNDEU-QGZVFWFLSA-N
XLogP5.05
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500422.49
LogP ≤ 55.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(1R)-1-(4-methoxyphenyl)ethyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide with MolForge

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Related Compounds

N-[(4-methoxyphenyl)methyl]-6-naphthalen-2-ylimidazo[1,2-a]pyridine-3-carboxamide
CID 164616105
N-[1-(3-methoxyphenyl)ethyl]quinoline-6-carboxamide
CID 69276532
N-[1-(1H-pyrazol-4-yl)ethyl]quinoline-6-carboxamide
CID 103856354
N-[1-(4-methoxyphenyl)ethyl]-1-methyl-4-pyridin-4-ylpyrrole-2-carboxamide
CID 53159767
2-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 84580740
N-[(1S)-1-(4-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 39853258
N-(2,2-difluoroethyl)-6-(2-quinolin-6-yl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)imidazo[1,2-a]pyridine-3-carboxamide
CID 168773021
1-ethyl-4-(4-methoxyphenyl)-N-(1-pyridin-3-ylethyl)pyrrole-2-carboxamide
CID 53147781
4-[(1S)-1-[[7-phenyl-3-(quinoline-6-carbonyl)-[1,2,4]triazolo[4,3-a]pyridine-5-carbonyl]amino]ethyl]benzoic acid
CID 176772508
N-[(1S)-1-(4-methylphenyl)ethyl]-3-quinolin-3-ylbenzamide
CID 92883224
N-[(1R)-1-(4-methylphenyl)ethyl]-3-quinolin-3-ylbenzamide
CID 92883223
N-[(1S)-1-(4-methoxyphenyl)ethyl]-1-methylpyrazole-4-carboxamide
CID 96582836

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(4-methoxyphenyl)ethyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[(1R)-1-(4-methoxyphenyl)ethyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide (CID 164628072) is N-[(1R)-1-(4-methoxyphenyl)ethyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[(1R)-1-(4-methoxyphenyl)ethyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[(1R)-1-(4-methoxyphenyl)ethyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide is COc1ccc([C@@H](C)NC(=O)c2cnc3ccc(-c4ccc5ncccc5c4)cn23)cc1.
What is the InChIKey of N-[(1R)-1-(4-methoxyphenyl)ethyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is DWARRSITHQNDEU-QGZVFWFLSA-N. The full InChI is InChI=1S/C26H22N4O2/c1-17(18-5-9-22(32-2)10-6-18)29-26(31)24-15-28-25-12-8-21(16-30(24)25)19-7-11-23-20(14-19)4-3-13-27-23/h3-17H,1-2H3,(H,29,31)/t17-/m1/s1.
What are the key properties of N-[(1R)-1-(4-methoxyphenyl)ethyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide?
N-[(1R)-1-(4-methoxyphenyl)ethyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 422.49 g/mol, XLogP of 5.05, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(4-methoxyphenyl)ethyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 164628072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).