ethyl 5,6-dihydroimidazo[1,5-a]pyridine-7-carboxylate

C10H12N2O2 — CID 10750263

IUPACethyl 5,6-dihydroimidazo[1,5-a]pyridine-7-carboxylate
SMILESCCOC(=O)C1=Cc2cncn2CC1
InChIInChI=1S/C10H12N2O2/c1-2-14-10(13)8-3-4-12-7-11-6-9(12)5-8/h5-7H,2-4H2,1H3
InChIKeyHDNRAYPOKBZVKB-UHFFFAOYSA-N
MW192.22 g/mol
LogP1.23
Rot. Bonds2

About ethyl 5,6-dihydroimidazo[1,5-a]pyridine-7-carboxylate

ethyl 5,6-dihydroimidazo[1,5-a]pyridine-7-carboxylate (PubChem CID 10750263) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is ethyl 5,6-dihydroimidazo[1,5-a]pyridine-7-carboxylate.

Molecular Properties

Compound Nameethyl 5,6-dihydroimidazo[1,5-a]pyridine-7-carboxylate
PubChem CID10750263
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC Nameethyl 5,6-dihydroimidazo[1,5-a]pyridine-7-carboxylate
SMILESCCOC(=O)C1=Cc2cncn2CC1
InChIInChI=1S/C10H12N2O2/c1-2-14-10(13)8-3-4-12-7-11-6-9(12)5-8/h5-7H,2-4H2,1H3
InChIKeyHDNRAYPOKBZVKB-UHFFFAOYSA-N
XLogP1.23
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 24972449
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CID 3304100
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ethyl 5-methyl-2H-pyrrole-3-carboxylate
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ethyl 6-oxo-2,3-dihydro-1H-pyridine-4-carboxylate
CID 67531102
ethyl 1-benzyl-3,6-dihydro-2H-pyridine-4-carboxylate
CID 787906
ethyl 5-[4-(3-methylimidazol-4-yl)piperidin-1-yl]-1,3,4-oxadiazole-2-carboxylate
CID 167869095
ethyl cycloundecene-1-carboxylate
CID 154164177
ethyl 2-methyl-3H-pyrrole-4-carboxylate
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Frequently Asked Questions

What is the IUPAC name of ethyl 5,6-dihydroimidazo[1,5-a]pyridine-7-carboxylate?
The IUPAC name of ethyl 5,6-dihydroimidazo[1,5-a]pyridine-7-carboxylate (CID 10750263) is ethyl 5,6-dihydroimidazo[1,5-a]pyridine-7-carboxylate.
What is the SMILES notation for ethyl 5,6-dihydroimidazo[1,5-a]pyridine-7-carboxylate?
The canonical SMILES for ethyl 5,6-dihydroimidazo[1,5-a]pyridine-7-carboxylate is CCOC(=O)C1=Cc2cncn2CC1.
What is the InChIKey of ethyl 5,6-dihydroimidazo[1,5-a]pyridine-7-carboxylate?
The InChIKey is HDNRAYPOKBZVKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2/c1-2-14-10(13)8-3-4-12-7-11-6-9(12)5-8/h5-7H,2-4H2,1H3.
What are the key properties of ethyl 5,6-dihydroimidazo[1,5-a]pyridine-7-carboxylate?
ethyl 5,6-dihydroimidazo[1,5-a]pyridine-7-carboxylate has a molecular weight of 192.22 g/mol, XLogP of 1.23, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 5,6-dihydroimidazo[1,5-a]pyridine-7-carboxylate is sourced from PubChem (CID 10750263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).