2-ethoxy-N-[4-(2-methoxyethoxy)phenyl]-2,4-dimethylpentanamide

C18H29NO4 — CID 133246574

IUPAC2-ethoxy-N-[4-(2-methoxyethoxy)phenyl]-2,4-dimethylpentanamide
SMILESCCOC(C)(CC(C)C)C(=O)Nc1ccc(OCCOC)cc1
InChIInChI=1S/C18H29NO4/c1-6-23-18(4,13-14(2)3)17(20)19-15-7-9-16(10-8-15)22-12-11-21-5/h7-10,14H,6,11-13H2,1-5H3,(H,19,20)
InChIKeyOEFKZMPQWXNARC-UHFFFAOYSA-N
MW323.43 g/mol
LogP3.49
Rot. Bonds10

About 2-ethoxy-N-[4-(2-methoxyethoxy)phenyl]-2,4-dimethylpentanamide

2-ethoxy-N-[4-(2-methoxyethoxy)phenyl]-2,4-dimethylpentanamide (PubChem CID 133246574) has the molecular formula C18H29NO4 and a molecular weight of 323.43 g/mol. Its IUPAC name is 2-ethoxy-N-[4-(2-methoxyethoxy)phenyl]-2,4-dimethylpentanamide.

Molecular Properties

Compound Name2-ethoxy-N-[4-(2-methoxyethoxy)phenyl]-2,4-dimethylpentanamide
PubChem CID133246574
Molecular FormulaC18H29NO4
Molecular Weight323.43 g/mol
Exact Mass323.21
IUPAC Name2-ethoxy-N-[4-(2-methoxyethoxy)phenyl]-2,4-dimethylpentanamide
SMILESCCOC(C)(CC(C)C)C(=O)Nc1ccc(OCCOC)cc1
InChIInChI=1S/C18H29NO4/c1-6-23-18(4,13-14(2)3)17(20)19-15-7-9-16(10-8-15)22-12-11-21-5/h7-10,14H,6,11-13H2,1-5H3,(H,19,20)
InChIKeyOEFKZMPQWXNARC-UHFFFAOYSA-N
XLogP3.49
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.43
LogP ≤ 53.49
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)-2-ethoxy-2,4-dimethyl-N-(4-propoxyphenyl)pentanamide
CID 100722896
(2R)-2-ethoxy-2,4-dimethyl-N-(4-propan-2-yloxyphenyl)pentanamide
CID 100722919
(2S)-2-ethoxy-2,4-dimethyl-N-(4-propan-2-yloxyphenyl)pentanamide
CID 100722911
(2S)-2-ethoxy-N-[4-(2-methoxyethoxy)phenyl]-2-methylheptanamide
CID 100728823
(2R)-N-[3-chloro-4-(2-methoxyethoxy)phenyl]-2-ethoxy-2,4-dimethylpentanamide
CID 100724136
(2S)-2-ethoxy-2,4-dimethyl-N-[4-(3-morpholin-4-ylpropoxy)phenyl]pentanamide
CID 100723548
N-[4-[2-(3,5-dimethylpiperidin-1-yl)ethoxy]phenyl]-2-ethoxy-2,4-dimethylpentanamide
CID 133246563
(2R)-N-[4-(2-bromoethoxy)phenyl]-2-methoxy-2,4-dimethylpentanamide
CID 100695331
(2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)phenyl]butanamide
CID 100710857
N-[4-[2-(diethylamino)ethoxy]phenyl]-2-methoxy-2,4-dimethylpentanamide
CID 133194288
2-ethoxy-2,4-dimethyl-N-[4-[2-(3-methylpiperidin-1-yl)ethoxy]phenyl]pentanamide
CID 133246561
(2R)-2-ethoxy-2,4-dimethyl-N-[4-[2-[(3S)-3-methylpiperidin-1-yl]ethoxy]phenyl]pentanamide
CID 125060296

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[4-(2-methoxyethoxy)phenyl]-2,4-dimethylpentanamide?
The IUPAC name of 2-ethoxy-N-[4-(2-methoxyethoxy)phenyl]-2,4-dimethylpentanamide (CID 133246574) is 2-ethoxy-N-[4-(2-methoxyethoxy)phenyl]-2,4-dimethylpentanamide.
What is the SMILES notation for 2-ethoxy-N-[4-(2-methoxyethoxy)phenyl]-2,4-dimethylpentanamide?
The canonical SMILES for 2-ethoxy-N-[4-(2-methoxyethoxy)phenyl]-2,4-dimethylpentanamide is CCOC(C)(CC(C)C)C(=O)Nc1ccc(OCCOC)cc1.
What is the InChIKey of 2-ethoxy-N-[4-(2-methoxyethoxy)phenyl]-2,4-dimethylpentanamide?
The InChIKey is OEFKZMPQWXNARC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO4/c1-6-23-18(4,13-14(2)3)17(20)19-15-7-9-16(10-8-15)22-12-11-21-5/h7-10,14H,6,11-13H2,1-5H3,(H,19,20).
What are the key properties of 2-ethoxy-N-[4-(2-methoxyethoxy)phenyl]-2,4-dimethylpentanamide?
2-ethoxy-N-[4-(2-methoxyethoxy)phenyl]-2,4-dimethylpentanamide has a molecular weight of 323.43 g/mol, XLogP of 3.49, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[4-(2-methoxyethoxy)phenyl]-2,4-dimethylpentanamide is sourced from PubChem (CID 133246574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).