(2R)-2-methoxy-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylhexanamide

C16H26N2O4 — CID 100774730

IUPAC(2R)-2-methoxy-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylhexanamide
SMILESCCCC[C@@](C)(OC)C(=O)Nc1ccc(OCCOC)nc1
InChIInChI=1S/C16H26N2O4/c1-5-6-9-16(2,21-4)15(19)18-13-7-8-14(17-12-13)22-11-10-20-3/h7-8,12H,5-6,9-11H2,1-4H3,(H,18,19)/t16-/m1/s1
InChIKeyKUZPWFJRJBWCEJ-MRXNPFEDSA-N
MW310.39 g/mol
LogP2.64
Rot. Bonds10

About (2R)-2-methoxy-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylhexanamide

(2R)-2-methoxy-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylhexanamide (PubChem CID 100774730) has the molecular formula C16H26N2O4 and a molecular weight of 310.39 g/mol. Its IUPAC name is (2R)-2-methoxy-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylhexanamide.

Molecular Properties

Compound Name(2R)-2-methoxy-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylhexanamide
PubChem CID100774730
Molecular FormulaC16H26N2O4
Molecular Weight310.39 g/mol
Exact Mass310.19
IUPAC Name(2R)-2-methoxy-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylhexanamide
SMILESCCCC[C@@](C)(OC)C(=O)Nc1ccc(OCCOC)nc1
InChIInChI=1S/C16H26N2O4/c1-5-6-9-16(2,21-4)15(19)18-13-7-8-14(17-12-13)22-11-10-20-3/h7-8,12H,5-6,9-11H2,1-4H3,(H,18,19)/t16-/m1/s1
InChIKeyKUZPWFJRJBWCEJ-MRXNPFEDSA-N
XLogP2.64
TPSA69.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.39
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-methoxy-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylhexanamide?
The IUPAC name of (2R)-2-methoxy-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylhexanamide (CID 100774730) is (2R)-2-methoxy-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylhexanamide.
What is the SMILES notation for (2R)-2-methoxy-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylhexanamide?
The canonical SMILES for (2R)-2-methoxy-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylhexanamide is CCCC[C@@](C)(OC)C(=O)Nc1ccc(OCCOC)nc1.
What is the InChIKey of (2R)-2-methoxy-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylhexanamide?
The InChIKey is KUZPWFJRJBWCEJ-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H26N2O4/c1-5-6-9-16(2,21-4)15(19)18-13-7-8-14(17-12-13)22-11-10-20-3/h7-8,12H,5-6,9-11H2,1-4H3,(H,18,19)/t16-/m1/s1.
What are the key properties of (2R)-2-methoxy-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylhexanamide?
(2R)-2-methoxy-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylhexanamide has a molecular weight of 310.39 g/mol, XLogP of 2.64, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methoxy-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylhexanamide is sourced from PubChem (CID 100774730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).