(3-amino-5-methoxyimidazo[1,5-a]pyridin-7-yl) ethyl carbonate

C11H13N3O4 — CID 69025274

IUPAC(3-amino-5-methoxyimidazo[1,5-a]pyridin-7-yl) ethyl carbonate
SMILESCCOC(=O)Oc1cc(OC)n2c(N)ncc2c1
InChIInChI=1S/C11H13N3O4/c1-3-17-11(15)18-8-4-7-6-13-10(12)14(7)9(5-8)16-2/h4-6H,3H2,1-2H3,(H2,12,13)
InChIKeyTVGYQYFJZFQITL-UHFFFAOYSA-N
MW251.24 g/mol
LogP1.46
Rot. Bonds3

About (3-amino-5-methoxyimidazo[1,5-a]pyridin-7-yl) ethyl carbonate

(3-amino-5-methoxyimidazo[1,5-a]pyridin-7-yl) ethyl carbonate (PubChem CID 69025274) has the molecular formula C11H13N3O4 and a molecular weight of 251.24 g/mol. Its IUPAC name is (3-amino-5-methoxyimidazo[1,5-a]pyridin-7-yl) ethyl carbonate.

Molecular Properties

Compound Name(3-amino-5-methoxyimidazo[1,5-a]pyridin-7-yl) ethyl carbonate
PubChem CID69025274
Molecular FormulaC11H13N3O4
Molecular Weight251.24 g/mol
Exact Mass251.09
IUPAC Name(3-amino-5-methoxyimidazo[1,5-a]pyridin-7-yl) ethyl carbonate
SMILESCCOC(=O)Oc1cc(OC)n2c(N)ncc2c1
InChIInChI=1S/C11H13N3O4/c1-3-17-11(15)18-8-4-7-6-13-10(12)14(7)9(5-8)16-2/h4-6H,3H2,1-2H3,(H2,12,13)
InChIKeyTVGYQYFJZFQITL-UHFFFAOYSA-N
XLogP1.46
TPSA88.08 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.24
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

(4-ethoxycarbonyloxyfuran-3-yl) ethyl carbonate
CID 70484352
(3,4-dimethylphenyl) ethyl carbonate
CID 19704470
ethyl 5-amino-3-methylpyridine-2-carboxylate
CID 118878054
ethyl (5-methyl-2-pyridinyl) carbonate
CID 70426723
ethyl [4-[4-(3,4,5-trimethoxybenzoyl)piperazine-1-carbonyl]phenyl] carbonate
CID 108929525
ethyl 2-(2-amino-5-methoxy-3-pyridinyl)acetate
CID 170599003
(5-bromo-2-methylpyrimidin-4-yl) ethyl carbonate
CID 23177790
ethyl 2-[3-(4-amino-3-methoxybenzoyl)imidazo[1,5-a]pyridin-7-yl]oxyacetate;hydrochloride
CID 11851979
ethyl [4-[4-(2-hydroxyethoxy)phenyl]phenyl] carbonate
CID 23213034
ethyl 5-amino-3-fluoropyridine-2-carboxylate
CID 119005075
(5-amino-4-chloro-2-methylphenyl) ethyl carbonate
CID 46856388
(4-ethoxycarbonyloxy-2,3-dimethoxynaphthalen-1-yl) ethyl carbonate
CID 14302873

Frequently Asked Questions

What is the IUPAC name of (3-amino-5-methoxyimidazo[1,5-a]pyridin-7-yl) ethyl carbonate?
The IUPAC name of (3-amino-5-methoxyimidazo[1,5-a]pyridin-7-yl) ethyl carbonate (CID 69025274) is (3-amino-5-methoxyimidazo[1,5-a]pyridin-7-yl) ethyl carbonate.
What is the SMILES notation for (3-amino-5-methoxyimidazo[1,5-a]pyridin-7-yl) ethyl carbonate?
The canonical SMILES for (3-amino-5-methoxyimidazo[1,5-a]pyridin-7-yl) ethyl carbonate is CCOC(=O)Oc1cc(OC)n2c(N)ncc2c1.
What is the InChIKey of (3-amino-5-methoxyimidazo[1,5-a]pyridin-7-yl) ethyl carbonate?
The InChIKey is TVGYQYFJZFQITL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O4/c1-3-17-11(15)18-8-4-7-6-13-10(12)14(7)9(5-8)16-2/h4-6H,3H2,1-2H3,(H2,12,13).
What are the key properties of (3-amino-5-methoxyimidazo[1,5-a]pyridin-7-yl) ethyl carbonate?
(3-amino-5-methoxyimidazo[1,5-a]pyridin-7-yl) ethyl carbonate has a molecular weight of 251.24 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (3-amino-5-methoxyimidazo[1,5-a]pyridin-7-yl) ethyl carbonate is sourced from PubChem (CID 69025274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).