4-butoxy-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide

C25H25N3O2 — CID 121055736

IUPAC4-butoxy-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
SMILESCCCCOc1ccc(C(=O)Nc2cccc(-c3cn4cccc(C)c4n3)c2)cc1
InChIInChI=1S/C25H25N3O2/c1-3-4-15-30-22-12-10-19(11-13-22)25(29)26-21-9-5-8-20(16-21)23-17-28-14-6-7-18(2)24(28)27-23/h5-14,16-17H,3-4,15H2,1-2H3,(H,26,29)
InChIKeyCJIOHDHHRMCOSF-UHFFFAOYSA-N
MW399.49 g/mol
LogP5.74
Rot. Bonds7

About 4-butoxy-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide

4-butoxy-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide (PubChem CID 121055736) has the molecular formula C25H25N3O2 and a molecular weight of 399.49 g/mol. Its IUPAC name is 4-butoxy-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide.

Molecular Properties

Compound Name4-butoxy-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
PubChem CID121055736
Molecular FormulaC25H25N3O2
Molecular Weight399.49 g/mol
Exact Mass399.19
IUPAC Name4-butoxy-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
SMILESCCCCOc1ccc(C(=O)Nc2cccc(-c3cn4cccc(C)c4n3)c2)cc1
InChIInChI=1S/C25H25N3O2/c1-3-4-15-30-22-12-10-19(11-13-22)25(29)26-21-9-5-8-20(16-21)23-17-28-14-6-7-18(2)24(28)27-23/h5-14,16-17H,3-4,15H2,1-2H3,(H,26,29)
InChIKeyCJIOHDHHRMCOSF-UHFFFAOYSA-N
XLogP5.74
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500399.49
LogP ≤ 55.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-butoxy-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 121055781
N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-4-(trifluoromethoxy)benzamide
CID 122284288
4-butoxy-N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide
CID 7080161
4-butoxy-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 121055735
N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)-4-pentoxybenzamide
CID 122285167
3,4-dimethoxy-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 121028699
N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-(4-methylphenoxy)acetamide
CID 122284247
3-(4-fluorophenoxy)-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 122284328
N-[3-[[4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]phenyl]pyridine-4-carboxamide
CID 55610449
N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-3,5-dinitrobenzamide
CID 121028685
4-ethoxy-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 121028764
N-(3-butoxyphenyl)-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide
CID 86880280

Frequently Asked Questions

What is the IUPAC name of 4-butoxy-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
The IUPAC name of 4-butoxy-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide (CID 121055736) is 4-butoxy-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide.
What is the SMILES notation for 4-butoxy-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
The canonical SMILES for 4-butoxy-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide is CCCCOc1ccc(C(=O)Nc2cccc(-c3cn4cccc(C)c4n3)c2)cc1.
What is the InChIKey of 4-butoxy-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
The InChIKey is CJIOHDHHRMCOSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N3O2/c1-3-4-15-30-22-12-10-19(11-13-22)25(29)26-21-9-5-8-20(16-21)23-17-28-14-6-7-18(2)24(28)27-23/h5-14,16-17H,3-4,15H2,1-2H3,(H,26,29).
What are the key properties of 4-butoxy-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
4-butoxy-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide has a molecular weight of 399.49 g/mol, XLogP of 5.74, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butoxy-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide is sourced from PubChem (CID 121055736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).