(2S)-2-ethoxy-N-(6-methoxy-2-methyl-3-pyridinyl)-2-methylpentanamide

C15H24N2O3 — CID 100776410

IUPAC(2S)-2-ethoxy-N-(6-methoxy-2-methyl-3-pyridinyl)-2-methylpentanamide
SMILESCCC[C@](C)(OCC)C(=O)Nc1ccc(OC)nc1C
InChIInChI=1S/C15H24N2O3/c1-6-10-15(4,20-7-2)14(18)17-12-8-9-13(19-5)16-11(12)3/h8-9H,6-7,10H2,1-5H3,(H,17,18)/t15-/m0/s1
InChIKeyYSYJEVOSJLXOAC-HNNXBMFYSA-N
MW280.37 g/mol
LogP2.93
Rot. Bonds7

About (2S)-2-ethoxy-N-(6-methoxy-2-methyl-3-pyridinyl)-2-methylpentanamide

(2S)-2-ethoxy-N-(6-methoxy-2-methyl-3-pyridinyl)-2-methylpentanamide (PubChem CID 100776410) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is (2S)-2-ethoxy-N-(6-methoxy-2-methyl-3-pyridinyl)-2-methylpentanamide.

Molecular Properties

Compound Name(2S)-2-ethoxy-N-(6-methoxy-2-methyl-3-pyridinyl)-2-methylpentanamide
PubChem CID100776410
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name(2S)-2-ethoxy-N-(6-methoxy-2-methyl-3-pyridinyl)-2-methylpentanamide
SMILESCCC[C@](C)(OCC)C(=O)Nc1ccc(OC)nc1C
InChIInChI=1S/C15H24N2O3/c1-6-10-15(4,20-7-2)14(18)17-12-8-9-13(19-5)16-11(12)3/h8-9H,6-7,10H2,1-5H3,(H,17,18)/t15-/m0/s1
InChIKeyYSYJEVOSJLXOAC-HNNXBMFYSA-N
XLogP2.93
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-ethoxy-N-(6-methoxy-2-methyl-3-pyridinyl)-2-methylpentanamide?
The IUPAC name of (2S)-2-ethoxy-N-(6-methoxy-2-methyl-3-pyridinyl)-2-methylpentanamide (CID 100776410) is (2S)-2-ethoxy-N-(6-methoxy-2-methyl-3-pyridinyl)-2-methylpentanamide.
What is the SMILES notation for (2S)-2-ethoxy-N-(6-methoxy-2-methyl-3-pyridinyl)-2-methylpentanamide?
The canonical SMILES for (2S)-2-ethoxy-N-(6-methoxy-2-methyl-3-pyridinyl)-2-methylpentanamide is CCC[C@](C)(OCC)C(=O)Nc1ccc(OC)nc1C.
What is the InChIKey of (2S)-2-ethoxy-N-(6-methoxy-2-methyl-3-pyridinyl)-2-methylpentanamide?
The InChIKey is YSYJEVOSJLXOAC-HNNXBMFYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-6-10-15(4,20-7-2)14(18)17-12-8-9-13(19-5)16-11(12)3/h8-9H,6-7,10H2,1-5H3,(H,17,18)/t15-/m0/s1.
What are the key properties of (2S)-2-ethoxy-N-(6-methoxy-2-methyl-3-pyridinyl)-2-methylpentanamide?
(2S)-2-ethoxy-N-(6-methoxy-2-methyl-3-pyridinyl)-2-methylpentanamide has a molecular weight of 280.37 g/mol, XLogP of 2.93, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-ethoxy-N-(6-methoxy-2-methyl-3-pyridinyl)-2-methylpentanamide is sourced from PubChem (CID 100776410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).