7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methoxyphenyl)ethyl]-N-propan-2-ylimidazo[1,2-a]pyridin-3-amine

C24H28N4O2 — CID 137409210

IUPAC7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methoxyphenyl)ethyl]-N-propan-2-ylimidazo[1,2-a]pyridin-3-amine
SMILESCOc1ccc(CCc2nc3cc(-c4c(C)noc4C)ccn3c2NC(C)C)cc1
InChIInChI=1S/C24H28N4O2/c1-15(2)25-24-21(11-8-18-6-9-20(29-5)10-7-18)26-22-14-19(12-13-28(22)24)23-16(3)27-30-17(23)4/h6-7,9-10,12-15,25H,8,11H2,1-5H3
InChIKeyMGJXSCGMFHZBCZ-UHFFFAOYSA-N
MW404.51 g/mol
LogP5.22
Rot. Bonds7

About 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methoxyphenyl)ethyl]-N-propan-2-ylimidazo[1,2-a]pyridin-3-amine

7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methoxyphenyl)ethyl]-N-propan-2-ylimidazo[1,2-a]pyridin-3-amine (PubChem CID 137409210) has the molecular formula C24H28N4O2 and a molecular weight of 404.51 g/mol. Its IUPAC name is 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methoxyphenyl)ethyl]-N-propan-2-ylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methoxyphenyl)ethyl]-N-propan-2-ylimidazo[1,2-a]pyridin-3-amine
PubChem CID137409210
Molecular FormulaC24H28N4O2
Molecular Weight404.51 g/mol
Exact Mass404.22
IUPAC Name7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methoxyphenyl)ethyl]-N-propan-2-ylimidazo[1,2-a]pyridin-3-amine
SMILESCOc1ccc(CCc2nc3cc(-c4c(C)noc4C)ccn3c2NC(C)C)cc1
InChIInChI=1S/C24H28N4O2/c1-15(2)25-24-21(11-8-18-6-9-20(29-5)10-7-18)26-22-14-19(12-13-28(22)24)23-16(3)27-30-17(23)4/h6-7,9-10,12-15,25H,8,11H2,1-5H3
InChIKeyMGJXSCGMFHZBCZ-UHFFFAOYSA-N
XLogP5.22
TPSA64.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500404.51
LogP ≤ 55.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methoxyphenyl)ethyl]-N-propan-2-ylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methoxyphenyl)ethyl]-N-propan-2-ylimidazo[1,2-a]pyridin-3-amine (CID 137409210) is 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methoxyphenyl)ethyl]-N-propan-2-ylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methoxyphenyl)ethyl]-N-propan-2-ylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methoxyphenyl)ethyl]-N-propan-2-ylimidazo[1,2-a]pyridin-3-amine is COc1ccc(CCc2nc3cc(-c4c(C)noc4C)ccn3c2NC(C)C)cc1.
What is the InChIKey of 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methoxyphenyl)ethyl]-N-propan-2-ylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is MGJXSCGMFHZBCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N4O2/c1-15(2)25-24-21(11-8-18-6-9-20(29-5)10-7-18)26-22-14-19(12-13-28(22)24)23-16(3)27-30-17(23)4/h6-7,9-10,12-15,25H,8,11H2,1-5H3.
What are the key properties of 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methoxyphenyl)ethyl]-N-propan-2-ylimidazo[1,2-a]pyridin-3-amine?
7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methoxyphenyl)ethyl]-N-propan-2-ylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 404.51 g/mol, XLogP of 5.22, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methoxyphenyl)ethyl]-N-propan-2-ylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 137409210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).