N-(3-butoxyphenyl)-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide

C20H23N3O2 — CID 86880280

IUPACN-(3-butoxyphenyl)-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide
SMILESCCCCOc1cccc(NC(=O)Cc2cn3cccc(C)c3n2)c1
InChIInChI=1S/C20H23N3O2/c1-3-4-11-25-18-9-5-8-16(12-18)21-19(24)13-17-14-23-10-6-7-15(2)20(23)22-17/h5-10,12,14H,3-4,11,13H2,1-2H3,(H,21,24)
InChIKeyBHMADTJJCYOPFI-UHFFFAOYSA-N
MW337.42 g/mol
LogP4.00
Rot. Bonds7

About N-(3-butoxyphenyl)-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide

N-(3-butoxyphenyl)-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide (PubChem CID 86880280) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is N-(3-butoxyphenyl)-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide.

Molecular Properties

Compound NameN-(3-butoxyphenyl)-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide
PubChem CID86880280
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC NameN-(3-butoxyphenyl)-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide
SMILESCCCCOc1cccc(NC(=O)Cc2cn3cccc(C)c3n2)c1
InChIInChI=1S/C20H23N3O2/c1-3-4-11-25-18-9-5-8-16(12-18)21-19(24)13-17-14-23-10-6-7-15(2)20(23)22-17/h5-10,12,14H,3-4,11,13H2,1-2H3,(H,21,24)
InChIKeyBHMADTJJCYOPFI-UHFFFAOYSA-N
XLogP4.00
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 54.00
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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Frequently Asked Questions

What is the IUPAC name of N-(3-butoxyphenyl)-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide?
The IUPAC name of N-(3-butoxyphenyl)-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide (CID 86880280) is N-(3-butoxyphenyl)-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide.
What is the SMILES notation for N-(3-butoxyphenyl)-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide?
The canonical SMILES for N-(3-butoxyphenyl)-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide is CCCCOc1cccc(NC(=O)Cc2cn3cccc(C)c3n2)c1.
What is the InChIKey of N-(3-butoxyphenyl)-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide?
The InChIKey is BHMADTJJCYOPFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-3-4-11-25-18-9-5-8-16(12-18)21-19(24)13-17-14-23-10-6-7-15(2)20(23)22-17/h5-10,12,14H,3-4,11,13H2,1-2H3,(H,21,24).
What are the key properties of N-(3-butoxyphenyl)-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide?
N-(3-butoxyphenyl)-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide has a molecular weight of 337.42 g/mol, XLogP of 4.00, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-butoxyphenyl)-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide is sourced from PubChem (CID 86880280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).