2-ethoxy-2-methyl-N-(2-methyl-6-propoxy-3-pyridinyl)heptanamide

C19H32N2O3 — CID 133205778

IUPAC2-ethoxy-2-methyl-N-(2-methyl-6-propoxy-3-pyridinyl)heptanamide
SMILESCCCCCC(C)(OCC)C(=O)Nc1ccc(OCCC)nc1C
InChIInChI=1S/C19H32N2O3/c1-6-9-10-13-19(5,24-8-3)18(22)21-16-11-12-17(20-15(16)4)23-14-7-2/h11-12H,6-10,13-14H2,1-5H3,(H,21,22)
InChIKeyUDKNQZJSOKXEND-UHFFFAOYSA-N
MW336.48 g/mol
LogP4.49
Rot. Bonds11

About 2-ethoxy-2-methyl-N-(2-methyl-6-propoxy-3-pyridinyl)heptanamide

2-ethoxy-2-methyl-N-(2-methyl-6-propoxy-3-pyridinyl)heptanamide (PubChem CID 133205778) has the molecular formula C19H32N2O3 and a molecular weight of 336.48 g/mol. Its IUPAC name is 2-ethoxy-2-methyl-N-(2-methyl-6-propoxy-3-pyridinyl)heptanamide.

Molecular Properties

Compound Name2-ethoxy-2-methyl-N-(2-methyl-6-propoxy-3-pyridinyl)heptanamide
PubChem CID133205778
Molecular FormulaC19H32N2O3
Molecular Weight336.48 g/mol
Exact Mass336.24
IUPAC Name2-ethoxy-2-methyl-N-(2-methyl-6-propoxy-3-pyridinyl)heptanamide
SMILESCCCCCC(C)(OCC)C(=O)Nc1ccc(OCCC)nc1C
InChIInChI=1S/C19H32N2O3/c1-6-9-10-13-19(5,24-8-3)18(22)21-16-11-12-17(20-15(16)4)23-14-7-2/h11-12H,6-10,13-14H2,1-5H3,(H,21,22)
InChIKeyUDKNQZJSOKXEND-UHFFFAOYSA-N
XLogP4.49
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.48
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2S)-N-(6-butoxy-2-methyl-3-pyridinyl)-2-ethoxy-2-methylpentanamide
CID 100776429
(2S)-N-(6-butoxy-2-methyl-3-pyridinyl)-2-methyl-2-propoxyhexanamide
CID 100778049
(2S)-N-[6-(2-ethoxyethoxy)-2-methyl-3-pyridinyl]-2-methyl-2-propoxyheptanamide
CID 100778190
(2S)-N-(6-butoxy-2-methyl-3-pyridinyl)-2-ethoxy-2,4-dimethylpentanamide
CID 100776244
(2S)-2-ethoxy-N-[6-(2-ethoxyethoxy)-2-methyl-3-pyridinyl]-2-methylpentanamide
CID 100776441
(2R)-2-ethoxy-2-methyl-N-(6-propoxy-3-pyridinyl)heptanamide
CID 100776755
(2S)-2-ethoxy-N-(6-methoxy-2-methyl-3-pyridinyl)-2-methylpentanamide
CID 100776410
(2S)-N-(6-ethoxy-2-methyl-3-pyridinyl)-2-methyl-2-propoxybutanamide
CID 100777585
2-ethoxy-2-methyl-N-(8-propoxyquinolin-5-yl)heptanamide
CID 133205790
2-ethoxy-4-methyl-N-(2-methyl-6-propoxy-3-pyridinyl)-2-(2-methylpropyl)pentanamide
CID 100776545
2-ethoxy-N-[6-(2-ethoxyethoxy)-2-methyl-3-pyridinyl]-2,4-dimethylpentanamide
CID 133205697
2-methoxy-N-[6-(2-methoxyethoxy)-2-methyl-3-pyridinyl]-2-methylpentanamide
CID 133205585

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-2-methyl-N-(2-methyl-6-propoxy-3-pyridinyl)heptanamide?
The IUPAC name of 2-ethoxy-2-methyl-N-(2-methyl-6-propoxy-3-pyridinyl)heptanamide (CID 133205778) is 2-ethoxy-2-methyl-N-(2-methyl-6-propoxy-3-pyridinyl)heptanamide.
What is the SMILES notation for 2-ethoxy-2-methyl-N-(2-methyl-6-propoxy-3-pyridinyl)heptanamide?
The canonical SMILES for 2-ethoxy-2-methyl-N-(2-methyl-6-propoxy-3-pyridinyl)heptanamide is CCCCCC(C)(OCC)C(=O)Nc1ccc(OCCC)nc1C.
What is the InChIKey of 2-ethoxy-2-methyl-N-(2-methyl-6-propoxy-3-pyridinyl)heptanamide?
The InChIKey is UDKNQZJSOKXEND-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2O3/c1-6-9-10-13-19(5,24-8-3)18(22)21-16-11-12-17(20-15(16)4)23-14-7-2/h11-12H,6-10,13-14H2,1-5H3,(H,21,22).
What are the key properties of 2-ethoxy-2-methyl-N-(2-methyl-6-propoxy-3-pyridinyl)heptanamide?
2-ethoxy-2-methyl-N-(2-methyl-6-propoxy-3-pyridinyl)heptanamide has a molecular weight of 336.48 g/mol, XLogP of 4.49, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-2-methyl-N-(2-methyl-6-propoxy-3-pyridinyl)heptanamide is sourced from PubChem (CID 133205778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).