N-[2-[4-(2-acetamidophenoxy)butoxy]phenyl]acetamide

C20H24N2O4 — CID 3708150

IUPACN-[2-[4-(2-acetamidophenoxy)butoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1OCCCCOc1ccccc1NC(C)=O
InChIInChI=1S/C20H24N2O4/c1-15(23)21-17-9-3-5-11-19(17)25-13-7-8-14-26-20-12-6-4-10-18(20)22-16(2)24/h3-6,9-12H,7-8,13-14H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyRQRDZESSRTZJTK-UHFFFAOYSA-N
MW356.42 g/mol
LogP3.84
Rot. Bonds9

About N-[2-[4-(2-acetamidophenoxy)butoxy]phenyl]acetamide

N-[2-[4-(2-acetamidophenoxy)butoxy]phenyl]acetamide (PubChem CID 3708150) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is N-[2-[4-(2-acetamidophenoxy)butoxy]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-[4-(2-acetamidophenoxy)butoxy]phenyl]acetamide
PubChem CID3708150
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC NameN-[2-[4-(2-acetamidophenoxy)butoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1OCCCCOc1ccccc1NC(C)=O
InChIInChI=1S/C20H24N2O4/c1-15(23)21-17-9-3-5-11-19(17)25-13-7-8-14-26-20-12-6-4-10-18(20)22-16(2)24/h3-6,9-12H,7-8,13-14H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyRQRDZESSRTZJTK-UHFFFAOYSA-N
XLogP3.84
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 53.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[10-(2-acetamidophenoxy)decoxy]phenyl]acetamide
CID 4569719
N-[2-(5-hydrazinyl-5-oxopentoxy)phenyl]acetamide
CID 63576193
N-[2-[2-(2-methylphenoxy)ethoxy]phenyl]acetamide
CID 9017902
N-[2-(4-oxo-4-phenylbutoxy)phenyl]acetamide
CID 13128525
N-[2-[2-(2-hydroxyethoxy)ethoxy]phenyl]acetamide
CID 61076230
N-[2-(2-prop-2-enoxyethoxy)phenyl]acetamide
CID 86096394
N-[2-[2-(4-fluorophenoxy)ethoxy]phenyl]acetamide
CID 7506171
N-[2-[2-(2-aminophenyl)ethoxy]phenyl]acetamide
CID 62496426
1,3-bis(2-butoxyphenyl)urea
CID 17170447
N-[2-[2-(4-fluorophenyl)sulfanylethoxy]phenyl]acetamide
CID 9137754
(2-acetamidophenyl) hypochlorite
CID 150463309
N-(2-butoxyphenyl)propanamide
CID 15943029

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(2-acetamidophenoxy)butoxy]phenyl]acetamide?
The IUPAC name of N-[2-[4-(2-acetamidophenoxy)butoxy]phenyl]acetamide (CID 3708150) is N-[2-[4-(2-acetamidophenoxy)butoxy]phenyl]acetamide.
What is the SMILES notation for N-[2-[4-(2-acetamidophenoxy)butoxy]phenyl]acetamide?
The canonical SMILES for N-[2-[4-(2-acetamidophenoxy)butoxy]phenyl]acetamide is CC(=O)Nc1ccccc1OCCCCOc1ccccc1NC(C)=O.
What is the InChIKey of N-[2-[4-(2-acetamidophenoxy)butoxy]phenyl]acetamide?
The InChIKey is RQRDZESSRTZJTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-15(23)21-17-9-3-5-11-19(17)25-13-7-8-14-26-20-12-6-4-10-18(20)22-16(2)24/h3-6,9-12H,7-8,13-14H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of N-[2-[4-(2-acetamidophenoxy)butoxy]phenyl]acetamide?
N-[2-[4-(2-acetamidophenoxy)butoxy]phenyl]acetamide has a molecular weight of 356.42 g/mol, XLogP of 3.84, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(2-acetamidophenoxy)butoxy]phenyl]acetamide is sourced from PubChem (CID 3708150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).