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

C10H13NO — CID 167037500

IUPAC7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine
SMILESCC1(C)Cc2ncccc2CO1
InChIInChI=1S/C10H13NO/c1-10(2)6-9-8(7-12-10)4-3-5-11-9/h3-5H,6-7H2,1-2H3
InChIKeyNPHLWDZJOJWBDW-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.93
Rot. Bonds

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

7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine (PubChem CID 167037500) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is 7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine.

Molecular Properties

Compound Name7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine
PubChem CID167037500
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine
SMILESCC1(C)Cc2ncccc2CO1
InChIInChI=1S/C10H13NO/c1-10(2)6-9-8(7-12-10)4-3-5-11-9/h3-5H,6-7H2,1-2H3
InChIKeyNPHLWDZJOJWBDW-UHFFFAOYSA-N
XLogP1.93
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine?
The IUPAC name of 7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine (CID 167037500) is 7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine.
What is the SMILES notation for 7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine?
The canonical SMILES for 7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine is CC1(C)Cc2ncccc2CO1.
What is the InChIKey of 7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine?
The InChIKey is NPHLWDZJOJWBDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO/c1-10(2)6-9-8(7-12-10)4-3-5-11-9/h3-5H,6-7H2,1-2H3.
What are the key properties of 7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine?
7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine has a molecular weight of 163.22 g/mol, XLogP of 1.93, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine is sourced from PubChem (CID 167037500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).