N-[(1R)-1-phenylethyl]-3-pyridin-4-ylimidazo[1,2-a]pyridine-2-carboxamide

C21H18N4O — CID 95101848

IUPACN-[(1R)-1-phenylethyl]-3-pyridin-4-ylimidazo[1,2-a]pyridine-2-carboxamide
SMILESC[C@@H](NC(=O)c1nc2ccccn2c1-c1ccncc1)c1ccccc1
InChIInChI=1S/C21H18N4O/c1-15(16-7-3-2-4-8-16)23-21(26)19-20(17-10-12-22-13-11-17)25-14-6-5-9-18(25)24-19/h2-15H,1H3,(H,23,26)/t15-/m1/s1
InChIKeyYVEDYSYFNRDUML-OAHLLOKOSA-N
MW342.40 g/mol
LogP3.89
Rot. Bonds4

About N-[(1R)-1-phenylethyl]-3-pyridin-4-ylimidazo[1,2-a]pyridine-2-carboxamide

N-[(1R)-1-phenylethyl]-3-pyridin-4-ylimidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 95101848) has the molecular formula C21H18N4O and a molecular weight of 342.40 g/mol. Its IUPAC name is N-[(1R)-1-phenylethyl]-3-pyridin-4-ylimidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-phenylethyl]-3-pyridin-4-ylimidazo[1,2-a]pyridine-2-carboxamide
PubChem CID95101848
Molecular FormulaC21H18N4O
Molecular Weight342.40 g/mol
Exact Mass342.15
IUPAC NameN-[(1R)-1-phenylethyl]-3-pyridin-4-ylimidazo[1,2-a]pyridine-2-carboxamide
SMILESC[C@@H](NC(=O)c1nc2ccccn2c1-c1ccncc1)c1ccccc1
InChIInChI=1S/C21H18N4O/c1-15(16-7-3-2-4-8-16)23-21(26)19-20(17-10-12-22-13-11-17)25-14-6-5-9-18(25)24-19/h2-15H,1H3,(H,23,26)/t15-/m1/s1
InChIKeyYVEDYSYFNRDUML-OAHLLOKOSA-N
XLogP3.89
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-bromo-N-(1-phenylethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 140676211
3-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine-2-carboxylic acid
CID 142784458
3-(4-chlorophenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 53168289
N-[(1R)-1-phenylethyl]pyridine-4-carboxamide
CID 730033
N-(2-methylpropyl)-3-thiophen-3-ylimidazo[1,2-a]pyridine-2-carboxamide
CID 53168327
3-chloro-N-(1-phenylethyl)pyrazolo[1,5-a]pyridine-2-carboxamide
CID 75768800
1-methyl-N-(1-phenylethyl)-4-pyridin-4-ylpyrrole-2-carboxamide
CID 71841032
2-methyl-N-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 72895080
3-N-methyl-3-N-phenyl-1-N-(1-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070419
1-(4-ethoxyphenyl)-N-[(1R)-1-phenylethyl]-5-pyridin-4-yltriazole-4-carboxamide
CID 95091553
3-N-(4-methylphenyl)-1-N-(1-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070418
N-[(1S)-1-pyridin-4-ylethyl]quinoline-2-carboxamide
CID 30479872

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-phenylethyl]-3-pyridin-4-ylimidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-[(1R)-1-phenylethyl]-3-pyridin-4-ylimidazo[1,2-a]pyridine-2-carboxamide (CID 95101848) is N-[(1R)-1-phenylethyl]-3-pyridin-4-ylimidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-[(1R)-1-phenylethyl]-3-pyridin-4-ylimidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-[(1R)-1-phenylethyl]-3-pyridin-4-ylimidazo[1,2-a]pyridine-2-carboxamide is C[C@@H](NC(=O)c1nc2ccccn2c1-c1ccncc1)c1ccccc1.
What is the InChIKey of N-[(1R)-1-phenylethyl]-3-pyridin-4-ylimidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is YVEDYSYFNRDUML-OAHLLOKOSA-N. The full InChI is InChI=1S/C21H18N4O/c1-15(16-7-3-2-4-8-16)23-21(26)19-20(17-10-12-22-13-11-17)25-14-6-5-9-18(25)24-19/h2-15H,1H3,(H,23,26)/t15-/m1/s1.
What are the key properties of N-[(1R)-1-phenylethyl]-3-pyridin-4-ylimidazo[1,2-a]pyridine-2-carboxamide?
N-[(1R)-1-phenylethyl]-3-pyridin-4-ylimidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 342.40 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-phenylethyl]-3-pyridin-4-ylimidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 95101848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).