N-[1-(4-ethoxyphenyl)ethyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide

C19H21N3O2 — CID 87051435

IUPACN-[1-(4-ethoxyphenyl)ethyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCCOc1ccc(C(C)NC(=O)c2cn3cc(C)ccc3n2)cc1
InChIInChI=1S/C19H21N3O2/c1-4-24-16-8-6-15(7-9-16)14(3)20-19(23)17-12-22-11-13(2)5-10-18(22)21-17/h5-12,14H,4H2,1-3H3,(H,20,23)
InChIKeyGTOAFEDDAQHISE-UHFFFAOYSA-N
MW323.40 g/mol
LogP3.53
Rot. Bonds5

About N-[1-(4-ethoxyphenyl)ethyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide

N-[1-(4-ethoxyphenyl)ethyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 87051435) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is N-[1-(4-ethoxyphenyl)ethyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(4-ethoxyphenyl)ethyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide
PubChem CID87051435
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC NameN-[1-(4-ethoxyphenyl)ethyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCCOc1ccc(C(C)NC(=O)c2cn3cc(C)ccc3n2)cc1
InChIInChI=1S/C19H21N3O2/c1-4-24-16-8-6-15(7-9-16)14(3)20-19(23)17-12-22-11-13(2)5-10-18(22)21-17/h5-12,14H,4H2,1-3H3,(H,20,23)
InChIKeyGTOAFEDDAQHISE-UHFFFAOYSA-N
XLogP3.53
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-ethoxyphenyl)ethyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-[1-(4-ethoxyphenyl)ethyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide (CID 87051435) is N-[1-(4-ethoxyphenyl)ethyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-[1-(4-ethoxyphenyl)ethyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-[1-(4-ethoxyphenyl)ethyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide is CCOc1ccc(C(C)NC(=O)c2cn3cc(C)ccc3n2)cc1.
What is the InChIKey of N-[1-(4-ethoxyphenyl)ethyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is GTOAFEDDAQHISE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-4-24-16-8-6-15(7-9-16)14(3)20-19(23)17-12-22-11-13(2)5-10-18(22)21-17/h5-12,14H,4H2,1-3H3,(H,20,23).
What are the key properties of N-[1-(4-ethoxyphenyl)ethyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide?
N-[1-(4-ethoxyphenyl)ethyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 323.40 g/mol, XLogP of 3.53, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-ethoxyphenyl)ethyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 87051435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).