(6-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-methoxybenzoate

C17H16N2O3 — CID 18099535

IUPAC(6-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-methoxybenzoate
SMILESCOc1cccc(C(=O)OCc2cn3cc(C)ccc3n2)c1
InChIInChI=1S/C17H16N2O3/c1-12-6-7-16-18-14(10-19(16)9-12)11-22-17(20)13-4-3-5-15(8-13)21-2/h3-10H,11H2,1-2H3
InChIKeyNHRZWSGIHFSICF-UHFFFAOYSA-N
MW296.33 g/mol
LogP3.01
Rot. Bonds4

About (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-methoxybenzoate

(6-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-methoxybenzoate (PubChem CID 18099535) has the molecular formula C17H16N2O3 and a molecular weight of 296.33 g/mol. Its IUPAC name is (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-methoxybenzoate.

Molecular Properties

Compound Name(6-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-methoxybenzoate
PubChem CID18099535
Molecular FormulaC17H16N2O3
Molecular Weight296.33 g/mol
Exact Mass296.12
IUPAC Name(6-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-methoxybenzoate
SMILESCOc1cccc(C(=O)OCc2cn3cc(C)ccc3n2)c1
InChIInChI=1S/C17H16N2O3/c1-12-6-7-16-18-14(10-19(16)9-12)11-22-17(20)13-4-3-5-15(8-13)21-2/h3-10H,11H2,1-2H3
InChIKeyNHRZWSGIHFSICF-UHFFFAOYSA-N
XLogP3.01
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4-methoxyphenyl)methyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 24617007
(6-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-(2-oxopyrrolidin-1-yl)benzoate
CID 9477215
(6-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-chloro-4,5-dimethoxybenzoate
CID 18099823
N-ethyl-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 51112147
N-(2-methoxyethyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 134024136
methyl 2-[[3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]acetate
CID 52552732
N-[(2,4-dimethoxyphenyl)methyl]-N-methyl-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 55511756
ethyl 3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoate
CID 112788039
3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-propylbenzamide
CID 30661051
N-[3-(methylamino)propyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 119430842
(2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl 3-methoxybenzoate
CID 46339751
N-(2,5-dimethylphenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 42063589

Frequently Asked Questions

What is the IUPAC name of (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-methoxybenzoate?
The IUPAC name of (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-methoxybenzoate (CID 18099535) is (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-methoxybenzoate.
What is the SMILES notation for (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-methoxybenzoate?
The canonical SMILES for (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-methoxybenzoate is COc1cccc(C(=O)OCc2cn3cc(C)ccc3n2)c1.
What is the InChIKey of (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-methoxybenzoate?
The InChIKey is NHRZWSGIHFSICF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O3/c1-12-6-7-16-18-14(10-19(16)9-12)11-22-17(20)13-4-3-5-15(8-13)21-2/h3-10H,11H2,1-2H3.
What are the key properties of (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-methoxybenzoate?
(6-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-methoxybenzoate has a molecular weight of 296.33 g/mol, XLogP of 3.01, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-methoxybenzoate is sourced from PubChem (CID 18099535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).