N-acetyl-2-[4-(2-methoxyethoxy)phenyl]propanamide

C14H19NO4 — CID 71176755

IUPACN-acetyl-2-[4-(2-methoxyethoxy)phenyl]propanamide
SMILESCOCCOc1ccc(C(C)C(=O)NC(C)=O)cc1
InChIInChI=1S/C14H19NO4/c1-10(14(17)15-11(2)16)12-4-6-13(7-5-12)19-9-8-18-3/h4-7,10H,8-9H2,1-3H3,(H,15,16,17)
InChIKeyMTEGFYXSKRWJQE-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.48
Rot. Bonds6

About N-acetyl-2-[4-(2-methoxyethoxy)phenyl]propanamide

N-acetyl-2-[4-(2-methoxyethoxy)phenyl]propanamide (PubChem CID 71176755) has the molecular formula C14H19NO4 and a molecular weight of 265.31 g/mol. Its IUPAC name is N-acetyl-2-[4-(2-methoxyethoxy)phenyl]propanamide.

Molecular Properties

Compound NameN-acetyl-2-[4-(2-methoxyethoxy)phenyl]propanamide
PubChem CID71176755
Molecular FormulaC14H19NO4
Molecular Weight265.31 g/mol
Exact Mass265.13
IUPAC NameN-acetyl-2-[4-(2-methoxyethoxy)phenyl]propanamide
SMILESCOCCOc1ccc(C(C)C(=O)NC(C)=O)cc1
InChIInChI=1S/C14H19NO4/c1-10(14(17)15-11(2)16)12-4-6-13(7-5-12)19-9-8-18-3/h4-7,10H,8-9H2,1-3H3,(H,15,16,17)
InChIKeyMTEGFYXSKRWJQE-UHFFFAOYSA-N
XLogP1.48
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.48
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

2-[4-(2-methoxyethoxy)phenyl]propanoic acid
CID 112512140
N-acetyl-2-[4-(2-methoxyethoxy)phenyl]acetamide
CID 70228842
methyl 2-hydroxy-2-[4-(2-methoxyethoxy)phenyl]acetate
CID 117353011
methoxy-[4-[4-(2-methoxyethoxy)phenyl]phenyl]methanol
CID 134401499
2-chloro-2-[4-(2-methoxyethoxy)phenyl]acetic acid
CID 112512422
2-amino-2-[4-(2-methoxyethoxy)phenyl]acetic acid
CID 77128718
methyl 2-(4-pentoxyphenyl)propanoate
CID 69403046
1,2-bis[4-(2-methoxyethoxy)phenyl]ethane-1,2-diamine
CID 101255138
N-[4-(2-methoxyethoxy)phenyl]-3-propan-2-yloxypropanamide
CID 86981512
methyl 3-[4-[(1R)-1-hydroxyethyl]phenoxy]propanoate
CID 78955010
methyl 2-(4-ethoxyphenyl)propanoate
CID 62394502
1-(1-iodoethyl)-4-[2-(2-methoxyethoxy)ethoxy]benzene
CID 89292471

Frequently Asked Questions

What is the IUPAC name of N-acetyl-2-[4-(2-methoxyethoxy)phenyl]propanamide?
The IUPAC name of N-acetyl-2-[4-(2-methoxyethoxy)phenyl]propanamide (CID 71176755) is N-acetyl-2-[4-(2-methoxyethoxy)phenyl]propanamide.
What is the SMILES notation for N-acetyl-2-[4-(2-methoxyethoxy)phenyl]propanamide?
The canonical SMILES for N-acetyl-2-[4-(2-methoxyethoxy)phenyl]propanamide is COCCOc1ccc(C(C)C(=O)NC(C)=O)cc1.
What is the InChIKey of N-acetyl-2-[4-(2-methoxyethoxy)phenyl]propanamide?
The InChIKey is MTEGFYXSKRWJQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO4/c1-10(14(17)15-11(2)16)12-4-6-13(7-5-12)19-9-8-18-3/h4-7,10H,8-9H2,1-3H3,(H,15,16,17).
What are the key properties of N-acetyl-2-[4-(2-methoxyethoxy)phenyl]propanamide?
N-acetyl-2-[4-(2-methoxyethoxy)phenyl]propanamide has a molecular weight of 265.31 g/mol, XLogP of 1.48, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-acetyl-2-[4-(2-methoxyethoxy)phenyl]propanamide is sourced from PubChem (CID 71176755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).