4-butoxy-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide

C22H25N3O2 — CID 90569862

IUPAC4-butoxy-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide
SMILESCCCCOc1ccc(C(=O)N(Cc2cnc3ccccn23)C2CC2)cc1
InChIInChI=1S/C22H25N3O2/c1-2-3-14-27-20-11-7-17(8-12-20)22(26)25(18-9-10-18)16-19-15-23-21-6-4-5-13-24(19)21/h4-8,11-13,15,18H,2-3,9-10,14,16H2,1H3
InChIKeyUGYKDUGSANYWAS-UHFFFAOYSA-N
MW363.46 g/mol
LogP4.32
Rot. Bonds8

About 4-butoxy-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide

4-butoxy-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide (PubChem CID 90569862) has the molecular formula C22H25N3O2 and a molecular weight of 363.46 g/mol. Its IUPAC name is 4-butoxy-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name4-butoxy-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide
PubChem CID90569862
Molecular FormulaC22H25N3O2
Molecular Weight363.46 g/mol
Exact Mass363.19
IUPAC Name4-butoxy-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide
SMILESCCCCOc1ccc(C(=O)N(Cc2cnc3ccccn23)C2CC2)cc1
InChIInChI=1S/C22H25N3O2/c1-2-3-14-27-20-11-7-17(8-12-20)22(26)25(18-9-10-18)16-19-15-23-21-6-4-5-13-24(19)21/h4-8,11-13,15,18H,2-3,9-10,14,16H2,1H3
InChIKeyUGYKDUGSANYWAS-UHFFFAOYSA-N
XLogP4.32
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 54.32
H-Bond Donors ≤ 50
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 4-butoxy-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide?
The IUPAC name of 4-butoxy-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide (CID 90569862) is 4-butoxy-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide.
What is the SMILES notation for 4-butoxy-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide?
The canonical SMILES for 4-butoxy-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide is CCCCOc1ccc(C(=O)N(Cc2cnc3ccccn23)C2CC2)cc1.
What is the InChIKey of 4-butoxy-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide?
The InChIKey is UGYKDUGSANYWAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O2/c1-2-3-14-27-20-11-7-17(8-12-20)22(26)25(18-9-10-18)16-19-15-23-21-6-4-5-13-24(19)21/h4-8,11-13,15,18H,2-3,9-10,14,16H2,1H3.
What are the key properties of 4-butoxy-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide?
4-butoxy-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide has a molecular weight of 363.46 g/mol, XLogP of 4.32, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butoxy-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide is sourced from PubChem (CID 90569862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).