(2R)-N-(6-ethoxy-5-methyl-3-pyridinyl)-2-methoxy-2-methylhexanamide

C16H26N2O3 — CID 100774797

IUPAC(2R)-N-(6-ethoxy-5-methyl-3-pyridinyl)-2-methoxy-2-methylhexanamide
SMILESCCCC[C@@](C)(OC)C(=O)Nc1cnc(OCC)c(C)c1
InChIInChI=1S/C16H26N2O3/c1-6-8-9-16(4,20-5)15(19)18-13-10-12(3)14(17-11-13)21-7-2/h10-11H,6-9H2,1-5H3,(H,18,19)/t16-/m1/s1
InChIKeyIIEZPQNKAJYTDN-MRXNPFEDSA-N
MW294.40 g/mol
LogP3.32
Rot. Bonds8

About (2R)-N-(6-ethoxy-5-methyl-3-pyridinyl)-2-methoxy-2-methylhexanamide

(2R)-N-(6-ethoxy-5-methyl-3-pyridinyl)-2-methoxy-2-methylhexanamide (PubChem CID 100774797) has the molecular formula C16H26N2O3 and a molecular weight of 294.40 g/mol. Its IUPAC name is (2R)-N-(6-ethoxy-5-methyl-3-pyridinyl)-2-methoxy-2-methylhexanamide.

Molecular Properties

Compound Name(2R)-N-(6-ethoxy-5-methyl-3-pyridinyl)-2-methoxy-2-methylhexanamide
PubChem CID100774797
Molecular FormulaC16H26N2O3
Molecular Weight294.40 g/mol
Exact Mass294.19
IUPAC Name(2R)-N-(6-ethoxy-5-methyl-3-pyridinyl)-2-methoxy-2-methylhexanamide
SMILESCCCC[C@@](C)(OC)C(=O)Nc1cnc(OCC)c(C)c1
InChIInChI=1S/C16H26N2O3/c1-6-8-9-16(4,20-5)15(19)18-13-10-12(3)14(17-11-13)21-7-2/h10-11H,6-9H2,1-5H3,(H,18,19)/t16-/m1/s1
InChIKeyIIEZPQNKAJYTDN-MRXNPFEDSA-N
XLogP3.32
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-(6-ethoxy-5-methyl-3-pyridinyl)-2-methoxy-2-methylhexanamide?
The IUPAC name of (2R)-N-(6-ethoxy-5-methyl-3-pyridinyl)-2-methoxy-2-methylhexanamide (CID 100774797) is (2R)-N-(6-ethoxy-5-methyl-3-pyridinyl)-2-methoxy-2-methylhexanamide.
What is the SMILES notation for (2R)-N-(6-ethoxy-5-methyl-3-pyridinyl)-2-methoxy-2-methylhexanamide?
The canonical SMILES for (2R)-N-(6-ethoxy-5-methyl-3-pyridinyl)-2-methoxy-2-methylhexanamide is CCCC[C@@](C)(OC)C(=O)Nc1cnc(OCC)c(C)c1.
What is the InChIKey of (2R)-N-(6-ethoxy-5-methyl-3-pyridinyl)-2-methoxy-2-methylhexanamide?
The InChIKey is IIEZPQNKAJYTDN-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H26N2O3/c1-6-8-9-16(4,20-5)15(19)18-13-10-12(3)14(17-11-13)21-7-2/h10-11H,6-9H2,1-5H3,(H,18,19)/t16-/m1/s1.
What are the key properties of (2R)-N-(6-ethoxy-5-methyl-3-pyridinyl)-2-methoxy-2-methylhexanamide?
(2R)-N-(6-ethoxy-5-methyl-3-pyridinyl)-2-methoxy-2-methylhexanamide has a molecular weight of 294.40 g/mol, XLogP of 3.32, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(6-ethoxy-5-methyl-3-pyridinyl)-2-methoxy-2-methylhexanamide is sourced from PubChem (CID 100774797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).