2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide

C11H15N3O2 — CID 906260

IUPAC2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide
SMILESCC1(C)Cc2nc(N)c(C(N)=O)cc2CO1
InChIInChI=1S/C11H15N3O2/c1-11(2)4-8-6(5-16-11)3-7(10(13)15)9(12)14-8/h3H,4-5H2,1-2H3,(H2,12,14)(H2,13,15)
InChIKeyJHSORNNCFSLEMF-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.61
Rot. Bonds1

About 2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide

2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide (PubChem CID 906260) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is 2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide
PubChem CID906260
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide
SMILESCC1(C)Cc2nc(N)c(C(N)=O)cc2CO1
InChIInChI=1S/C11H15N3O2/c1-11(2)4-8-6(5-16-11)3-7(10(13)15)9(12)14-8/h3H,4-5H2,1-2H3,(H2,12,14)(H2,13,15)
InChIKeyJHSORNNCFSLEMF-UHFFFAOYSA-N
XLogP0.61
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide?
The IUPAC name of 2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide (CID 906260) is 2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide.
What is the SMILES notation for 2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide?
The canonical SMILES for 2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide is CC1(C)Cc2nc(N)c(C(N)=O)cc2CO1.
What is the InChIKey of 2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide?
The InChIKey is JHSORNNCFSLEMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-11(2)4-8-6(5-16-11)3-7(10(13)15)9(12)14-8/h3H,4-5H2,1-2H3,(H2,12,14)(H2,13,15).
What are the key properties of 2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide?
2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide has a molecular weight of 221.26 g/mol, XLogP of 0.61, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide is sourced from PubChem (CID 906260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).