(4-pyridin-3-yloxyphenyl)methyl 7-methylimidazo[1,2-a]pyridine-3-carboxylate

C21H17N3O3 — CID 166189756

IUPAC(4-pyridin-3-yloxyphenyl)methyl 7-methylimidazo[1,2-a]pyridine-3-carboxylate
SMILESCc1ccn2c(C(=O)OCc3ccc(Oc4cccnc4)cc3)cnc2c1
InChIInChI=1S/C21H17N3O3/c1-15-8-10-24-19(13-23-20(24)11-15)21(25)26-14-16-4-6-17(7-5-16)27-18-3-2-9-22-12-18/h2-13H,14H2,1H3
InChIKeyAPRCZQXRBOBUKX-UHFFFAOYSA-N
MW359.39 g/mol
LogP4.19
Rot. Bonds5

About (4-pyridin-3-yloxyphenyl)methyl 7-methylimidazo[1,2-a]pyridine-3-carboxylate

(4-pyridin-3-yloxyphenyl)methyl 7-methylimidazo[1,2-a]pyridine-3-carboxylate (PubChem CID 166189756) has the molecular formula C21H17N3O3 and a molecular weight of 359.39 g/mol. Its IUPAC name is (4-pyridin-3-yloxyphenyl)methyl 7-methylimidazo[1,2-a]pyridine-3-carboxylate.

Molecular Properties

Compound Name(4-pyridin-3-yloxyphenyl)methyl 7-methylimidazo[1,2-a]pyridine-3-carboxylate
PubChem CID166189756
Molecular FormulaC21H17N3O3
Molecular Weight359.39 g/mol
Exact Mass359.13
IUPAC Name(4-pyridin-3-yloxyphenyl)methyl 7-methylimidazo[1,2-a]pyridine-3-carboxylate
SMILESCc1ccn2c(C(=O)OCc3ccc(Oc4cccnc4)cc3)cnc2c1
InChIInChI=1S/C21H17N3O3/c1-15-8-10-24-19(13-23-20(24)11-15)21(25)26-14-16-4-6-17(7-5-16)27-18-3-2-9-22-12-18/h2-13H,14H2,1H3
InChIKeyAPRCZQXRBOBUKX-UHFFFAOYSA-N
XLogP4.19
TPSA65.72 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.39
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

(4-pyridin-3-yloxyphenyl)methyl 3-methylimidazo[1,5-a]pyridine-6-carboxylate
CID 166189427
(4-methoxyphenyl)methyl 4-pyridin-3-yloxybenzoate
CID 60588638
7-methylimidazo[1,2-a]pyridine-3-carbohydrazide
CID 162421003
methyl 2-amino-3-(4-pyridin-3-yloxyphenyl)propanoate
CID 24730209
ethyl 7-fluoroimidazo[1,2-a]pyridine-3-carboxylate
CID 67259301
[4-(pyridine-3-carbonyloxymethyl)phenyl]methyl pyridine-3-carboxylate
CID 9413213
ethyl 7-pyrrolidin-1-ylimidazo[1,2-a]pyridine-3-carboxylate
CID 145001485
3-[(4-methylphenyl)methoxy]pyridine
CID 58445986
(4-pyridin-3-yloxyphenyl)methyl (E)-3-[4-(dimethylamino)phenyl]prop-2-enoate
CID 166194144
2-(4-pyridin-3-yloxyphenyl)ethanamine
CID 63815033
1-(4-pyridin-3-yloxyphenyl)ethanone
CID 3016094
ethyl 7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxylate;methanol
CID 178051371

Frequently Asked Questions

What is the IUPAC name of (4-pyridin-3-yloxyphenyl)methyl 7-methylimidazo[1,2-a]pyridine-3-carboxylate?
The IUPAC name of (4-pyridin-3-yloxyphenyl)methyl 7-methylimidazo[1,2-a]pyridine-3-carboxylate (CID 166189756) is (4-pyridin-3-yloxyphenyl)methyl 7-methylimidazo[1,2-a]pyridine-3-carboxylate.
What is the SMILES notation for (4-pyridin-3-yloxyphenyl)methyl 7-methylimidazo[1,2-a]pyridine-3-carboxylate?
The canonical SMILES for (4-pyridin-3-yloxyphenyl)methyl 7-methylimidazo[1,2-a]pyridine-3-carboxylate is Cc1ccn2c(C(=O)OCc3ccc(Oc4cccnc4)cc3)cnc2c1.
What is the InChIKey of (4-pyridin-3-yloxyphenyl)methyl 7-methylimidazo[1,2-a]pyridine-3-carboxylate?
The InChIKey is APRCZQXRBOBUKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3O3/c1-15-8-10-24-19(13-23-20(24)11-15)21(25)26-14-16-4-6-17(7-5-16)27-18-3-2-9-22-12-18/h2-13H,14H2,1H3.
What are the key properties of (4-pyridin-3-yloxyphenyl)methyl 7-methylimidazo[1,2-a]pyridine-3-carboxylate?
(4-pyridin-3-yloxyphenyl)methyl 7-methylimidazo[1,2-a]pyridine-3-carboxylate has a molecular weight of 359.39 g/mol, XLogP of 4.19, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (4-pyridin-3-yloxyphenyl)methyl 7-methylimidazo[1,2-a]pyridine-3-carboxylate is sourced from PubChem (CID 166189756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).