N-[(4-ethylphenyl)methyl]-3-(4-imidazo[4,5-b]pyridin-3-ylphenyl)propanamide

C24H24N4O — CID 20916234

IUPACN-[(4-ethylphenyl)methyl]-3-(4-imidazo[4,5-b]pyridin-3-ylphenyl)propanamide
SMILESCCc1ccc(CNC(=O)CCc2ccc(-n3cnc4cccnc43)cc2)cc1
InChIInChI=1S/C24H24N4O/c1-2-18-5-7-20(8-6-18)16-26-23(29)14-11-19-9-12-21(13-10-19)28-17-27-22-4-3-15-25-24(22)28/h3-10,12-13,15,17H,2,11,14,16H2,1H3,(H,26,29)
InChIKeyZEEGIMROAHQARM-UHFFFAOYSA-N
MW384.48 g/mol
LogP4.23
Rot. Bonds7

About N-[(4-ethylphenyl)methyl]-3-(4-imidazo[4,5-b]pyridin-3-ylphenyl)propanamide

N-[(4-ethylphenyl)methyl]-3-(4-imidazo[4,5-b]pyridin-3-ylphenyl)propanamide (PubChem CID 20916234) has the molecular formula C24H24N4O and a molecular weight of 384.48 g/mol. Its IUPAC name is N-[(4-ethylphenyl)methyl]-3-(4-imidazo[4,5-b]pyridin-3-ylphenyl)propanamide.

Molecular Properties

Compound NameN-[(4-ethylphenyl)methyl]-3-(4-imidazo[4,5-b]pyridin-3-ylphenyl)propanamide
PubChem CID20916234
Molecular FormulaC24H24N4O
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC NameN-[(4-ethylphenyl)methyl]-3-(4-imidazo[4,5-b]pyridin-3-ylphenyl)propanamide
SMILESCCc1ccc(CNC(=O)CCc2ccc(-n3cnc4cccnc43)cc2)cc1
InChIInChI=1S/C24H24N4O/c1-2-18-5-7-20(8-6-18)16-26-23(29)14-11-19-9-12-21(13-10-19)28-17-27-22-4-3-15-25-24(22)28/h3-10,12-13,15,17H,2,11,14,16H2,1H3,(H,26,29)
InChIKeyZEEGIMROAHQARM-UHFFFAOYSA-N
XLogP4.23
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylphenyl)methyl]-3-(4-imidazo[4,5-b]pyridin-3-ylphenyl)propanamide?
The IUPAC name of N-[(4-ethylphenyl)methyl]-3-(4-imidazo[4,5-b]pyridin-3-ylphenyl)propanamide (CID 20916234) is N-[(4-ethylphenyl)methyl]-3-(4-imidazo[4,5-b]pyridin-3-ylphenyl)propanamide.
What is the SMILES notation for N-[(4-ethylphenyl)methyl]-3-(4-imidazo[4,5-b]pyridin-3-ylphenyl)propanamide?
The canonical SMILES for N-[(4-ethylphenyl)methyl]-3-(4-imidazo[4,5-b]pyridin-3-ylphenyl)propanamide is CCc1ccc(CNC(=O)CCc2ccc(-n3cnc4cccnc43)cc2)cc1.
What is the InChIKey of N-[(4-ethylphenyl)methyl]-3-(4-imidazo[4,5-b]pyridin-3-ylphenyl)propanamide?
The InChIKey is ZEEGIMROAHQARM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O/c1-2-18-5-7-20(8-6-18)16-26-23(29)14-11-19-9-12-21(13-10-19)28-17-27-22-4-3-15-25-24(22)28/h3-10,12-13,15,17H,2,11,14,16H2,1H3,(H,26,29).
What are the key properties of N-[(4-ethylphenyl)methyl]-3-(4-imidazo[4,5-b]pyridin-3-ylphenyl)propanamide?
N-[(4-ethylphenyl)methyl]-3-(4-imidazo[4,5-b]pyridin-3-ylphenyl)propanamide has a molecular weight of 384.48 g/mol, XLogP of 4.23, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylphenyl)methyl]-3-(4-imidazo[4,5-b]pyridin-3-ylphenyl)propanamide is sourced from PubChem (CID 20916234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).