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

C11H16N4O2 — CID 15467470

IUPAC2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carbohydrazide
SMILESCC1(C)Cc2nc(N)c(C(=O)NN)cc2CO1
InChIInChI=1S/C11H16N4O2/c1-11(2)4-8-6(5-17-11)3-7(9(12)14-8)10(16)15-13/h3H,4-5,13H2,1-2H3,(H2,12,14)(H,15,16)
InChIKeyJLWRHICZGLAEIG-UHFFFAOYSA-N
MW236.27 g/mol
LogP0.12
Rot. Bonds1

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

2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carbohydrazide (PubChem CID 15467470) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is 2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carbohydrazide.

Molecular Properties

Compound Name2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carbohydrazide
PubChem CID15467470
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC Name2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carbohydrazide
SMILESCC1(C)Cc2nc(N)c(C(=O)NN)cc2CO1
InChIInChI=1S/C11H16N4O2/c1-11(2)4-8-6(5-17-11)3-7(9(12)14-8)10(16)15-13/h3H,4-5,13H2,1-2H3,(H2,12,14)(H,15,16)
InChIKeyJLWRHICZGLAEIG-UHFFFAOYSA-N
XLogP0.12
TPSA103.26 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 50.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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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-carbohydrazide?
The IUPAC name of 2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carbohydrazide (CID 15467470) is 2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carbohydrazide.
What is the SMILES notation for 2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carbohydrazide?
The canonical SMILES for 2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carbohydrazide is CC1(C)Cc2nc(N)c(C(=O)NN)cc2CO1.
What is the InChIKey of 2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carbohydrazide?
The InChIKey is JLWRHICZGLAEIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c1-11(2)4-8-6(5-17-11)3-7(9(12)14-8)10(16)15-13/h3H,4-5,13H2,1-2H3,(H2,12,14)(H,15,16).
What are the key properties of 2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carbohydrazide?
2-amino-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine-3-carbohydrazide has a molecular weight of 236.27 g/mol, XLogP of 0.12, 1 rotatable bonds, 3 hydrogen bond donors, and 5 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-carbohydrazide is sourced from PubChem (CID 15467470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).