spiro[5,7-dihydropyrano[4,3-b]pyridine-8,2'-cyclopropane]-1'-carboxylic acid

C11H11NO3 — CID 164899433

IUPACspiro[5,7-dihydropyrano[4,3-b]pyridine-8,2'-cyclopropane]-1'-carboxylic acid
SMILESO=C(O)C1CC12COCc1cccnc12
InChIInChI=1S/C11H11NO3/c13-10(14)8-4-11(8)6-15-5-7-2-1-3-12-9(7)11/h1-3,8H,4-6H2,(H,13,14)
InChIKeyWULQQHBDHSCRFU-UHFFFAOYSA-N
MW205.21 g/mol
LogP0.95
Rot. Bonds1

About spiro[5,7-dihydropyrano[4,3-b]pyridine-8,2'-cyclopropane]-1'-carboxylic acid

spiro[5,7-dihydropyrano[4,3-b]pyridine-8,2'-cyclopropane]-1'-carboxylic acid (PubChem CID 164899433) has the molecular formula C11H11NO3 and a molecular weight of 205.21 g/mol. Its IUPAC name is spiro[5,7-dihydropyrano[4,3-b]pyridine-8,2'-cyclopropane]-1'-carboxylic acid.

Molecular Properties

Compound Namespiro[5,7-dihydropyrano[4,3-b]pyridine-8,2'-cyclopropane]-1'-carboxylic acid
PubChem CID164899433
Molecular FormulaC11H11NO3
Molecular Weight205.21 g/mol
Exact Mass205.07
IUPAC Namespiro[5,7-dihydropyrano[4,3-b]pyridine-8,2'-cyclopropane]-1'-carboxylic acid
SMILESO=C(O)C1CC12COCc1cccnc12
InChIInChI=1S/C11H11NO3/c13-10(14)8-4-11(8)6-15-5-7-2-1-3-12-9(7)11/h1-3,8H,4-6H2,(H,13,14)
InChIKeyWULQQHBDHSCRFU-UHFFFAOYSA-N
XLogP0.95
TPSA59.42 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.21
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-methylspiro[2,3-dihydrochromene-4,2'-cyclopropane]-1'-carboxylic acid
CID 105472206
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CID 94419963
spiro[5H-furo[3,4-b]pyridine-7,3'-oxane]
CID 162728892
7-[(E)-2-morpholin-4-ylethenyl]-5H-furo[3,4-b]pyridin-7-ol
CID 157036942
7-amino-6-methyl-5,6-dihydrocyclopenta[b]pyridine-7-carboxylic acid
CID 112715027
N-(8-methylquinolin-5-yl)-6-oxaspiro[2.5]octane-2-carboxamide
CID 86769533
9,12,15,18,21-pentaoxa-3,27-diazatricyclo[21.4.0.02,7]heptacosa-1(23),2(7),3,5,24,26-hexaene
CID 101140723
2-pyrimidin-2-yl-2-azaspiro[4.5]decane-4-carboxylic acid
CID 122160567
sodium 3-(3-chloro-2-pyridinyl)oxetane-3-carboxylate
CID 156875975
2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)acetic acid
CID 79740284
N-(2-bromo-3-pyridinyl)-2,2-dimethylcyclopropane-1-carboxamide
CID 103841304
5,11-dihydro-[1]benzoxepino[3,4-b]pyridine-11-carboxylic acid
CID 10421800

Frequently Asked Questions

What is the IUPAC name of spiro[5,7-dihydropyrano[4,3-b]pyridine-8,2'-cyclopropane]-1'-carboxylic acid?
The IUPAC name of spiro[5,7-dihydropyrano[4,3-b]pyridine-8,2'-cyclopropane]-1'-carboxylic acid (CID 164899433) is spiro[5,7-dihydropyrano[4,3-b]pyridine-8,2'-cyclopropane]-1'-carboxylic acid.
What is the SMILES notation for spiro[5,7-dihydropyrano[4,3-b]pyridine-8,2'-cyclopropane]-1'-carboxylic acid?
The canonical SMILES for spiro[5,7-dihydropyrano[4,3-b]pyridine-8,2'-cyclopropane]-1'-carboxylic acid is O=C(O)C1CC12COCc1cccnc12.
What is the InChIKey of spiro[5,7-dihydropyrano[4,3-b]pyridine-8,2'-cyclopropane]-1'-carboxylic acid?
The InChIKey is WULQQHBDHSCRFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO3/c13-10(14)8-4-11(8)6-15-5-7-2-1-3-12-9(7)11/h1-3,8H,4-6H2,(H,13,14).
What are the key properties of spiro[5,7-dihydropyrano[4,3-b]pyridine-8,2'-cyclopropane]-1'-carboxylic acid?
spiro[5,7-dihydropyrano[4,3-b]pyridine-8,2'-cyclopropane]-1'-carboxylic acid has a molecular weight of 205.21 g/mol, XLogP of 0.95, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[5,7-dihydropyrano[4,3-b]pyridine-8,2'-cyclopropane]-1'-carboxylic acid is sourced from PubChem (CID 164899433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).