(6R)-3-ethoxy-1,6-dimethyl-3,6-dihydro-2H-pyridine

C9H17NO — CID 155070463

IUPAC(6R)-3-ethoxy-1,6-dimethyl-3,6-dihydro-2H-pyridine
SMILESCCOC1C=C[C@@H](C)N(C)C1
InChIInChI=1S/C9H17NO/c1-4-11-9-6-5-8(2)10(3)7-9/h5-6,8-9H,4,7H2,1-3H3/t8-,9?/m1/s1
InChIKeySCARDSUXHCGXIN-VEDVMXKPSA-N
MW155.24 g/mol
LogP1.28
Rot. Bonds2

About (6R)-3-ethoxy-1,6-dimethyl-3,6-dihydro-2H-pyridine

(6R)-3-ethoxy-1,6-dimethyl-3,6-dihydro-2H-pyridine (PubChem CID 155070463) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is (6R)-3-ethoxy-1,6-dimethyl-3,6-dihydro-2H-pyridine.

Molecular Properties

Compound Name(6R)-3-ethoxy-1,6-dimethyl-3,6-dihydro-2H-pyridine
PubChem CID155070463
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name(6R)-3-ethoxy-1,6-dimethyl-3,6-dihydro-2H-pyridine
SMILESCCOC1C=C[C@@H](C)N(C)C1
InChIInChI=1S/C9H17NO/c1-4-11-9-6-5-8(2)10(3)7-9/h5-6,8-9H,4,7H2,1-3H3/t8-,9?/m1/s1
InChIKeySCARDSUXHCGXIN-VEDVMXKPSA-N
XLogP1.28
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (6R)-3-ethoxy-1,6-dimethyl-3,6-dihydro-2H-pyridine?
The IUPAC name of (6R)-3-ethoxy-1,6-dimethyl-3,6-dihydro-2H-pyridine (CID 155070463) is (6R)-3-ethoxy-1,6-dimethyl-3,6-dihydro-2H-pyridine.
What is the SMILES notation for (6R)-3-ethoxy-1,6-dimethyl-3,6-dihydro-2H-pyridine?
The canonical SMILES for (6R)-3-ethoxy-1,6-dimethyl-3,6-dihydro-2H-pyridine is CCOC1C=C[C@@H](C)N(C)C1.
What is the InChIKey of (6R)-3-ethoxy-1,6-dimethyl-3,6-dihydro-2H-pyridine?
The InChIKey is SCARDSUXHCGXIN-VEDVMXKPSA-N. The full InChI is InChI=1S/C9H17NO/c1-4-11-9-6-5-8(2)10(3)7-9/h5-6,8-9H,4,7H2,1-3H3/t8-,9?/m1/s1.
What are the key properties of (6R)-3-ethoxy-1,6-dimethyl-3,6-dihydro-2H-pyridine?
(6R)-3-ethoxy-1,6-dimethyl-3,6-dihydro-2H-pyridine has a molecular weight of 155.24 g/mol, XLogP of 1.28, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-3-ethoxy-1,6-dimethyl-3,6-dihydro-2H-pyridine is sourced from PubChem (CID 155070463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).