N-[2-(3-methoxyphenoxy)ethyl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide

C19H21N3O3 — CID 134150873

IUPACN-[2-(3-methoxyphenoxy)ethyl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCOc1cccc(OCCNC(=O)c2c(C)nc3ccc(C)cn23)c1
InChIInChI=1S/C19H21N3O3/c1-13-7-8-17-21-14(2)18(22(17)12-13)19(23)20-9-10-25-16-6-4-5-15(11-16)24-3/h4-8,11-12H,9-10H2,1-3H3,(H,20,23)
InChIKeyXEPNTSLODCVRGQ-UHFFFAOYSA-N
MW339.40 g/mol
LogP2.77
Rot. Bonds6

About N-[2-(3-methoxyphenoxy)ethyl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide

N-[2-(3-methoxyphenoxy)ethyl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 134150873) has the molecular formula C19H21N3O3 and a molecular weight of 339.40 g/mol. Its IUPAC name is N-[2-(3-methoxyphenoxy)ethyl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(3-methoxyphenoxy)ethyl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID134150873
Molecular FormulaC19H21N3O3
Molecular Weight339.40 g/mol
Exact Mass339.16
IUPAC NameN-[2-(3-methoxyphenoxy)ethyl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCOc1cccc(OCCNC(=O)c2c(C)nc3ccc(C)cn23)c1
InChIInChI=1S/C19H21N3O3/c1-13-7-8-17-21-14(2)18(22(17)12-13)19(23)20-9-10-25-16-6-4-5-15(11-16)24-3/h4-8,11-12H,9-10H2,1-3H3,(H,20,23)
InChIKeyXEPNTSLODCVRGQ-UHFFFAOYSA-N
XLogP2.77
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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-[2-(3-methoxyphenoxy)ethyl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[2-(3-methoxyphenoxy)ethyl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide (CID 134150873) is N-[2-(3-methoxyphenoxy)ethyl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[2-(3-methoxyphenoxy)ethyl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[2-(3-methoxyphenoxy)ethyl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide is COc1cccc(OCCNC(=O)c2c(C)nc3ccc(C)cn23)c1.
What is the InChIKey of N-[2-(3-methoxyphenoxy)ethyl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is XEPNTSLODCVRGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O3/c1-13-7-8-17-21-14(2)18(22(17)12-13)19(23)20-9-10-25-16-6-4-5-15(11-16)24-3/h4-8,11-12H,9-10H2,1-3H3,(H,20,23).
What are the key properties of N-[2-(3-methoxyphenoxy)ethyl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide?
N-[2-(3-methoxyphenoxy)ethyl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 339.40 g/mol, XLogP of 2.77, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methoxyphenoxy)ethyl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 134150873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).