N-[4-(2-ethoxyethoxy)phenyl]-4-propan-2-yloxybenzamide

C20H25NO4 — CID 17130636

IUPACN-[4-(2-ethoxyethoxy)phenyl]-4-propan-2-yloxybenzamide
SMILESCCOCCOc1ccc(NC(=O)c2ccc(OC(C)C)cc2)cc1
InChIInChI=1S/C20H25NO4/c1-4-23-13-14-24-18-11-7-17(8-12-18)21-20(22)16-5-9-19(10-6-16)25-15(2)3/h5-12,15H,4,13-14H2,1-3H3,(H,21,22)
InChIKeyJHLYYGXAQAFOAV-UHFFFAOYSA-N
MW343.42 g/mol
LogP4.14
Rot. Bonds9

About N-[4-(2-ethoxyethoxy)phenyl]-4-propan-2-yloxybenzamide

N-[4-(2-ethoxyethoxy)phenyl]-4-propan-2-yloxybenzamide (PubChem CID 17130636) has the molecular formula C20H25NO4 and a molecular weight of 343.42 g/mol. Its IUPAC name is N-[4-(2-ethoxyethoxy)phenyl]-4-propan-2-yloxybenzamide.

Molecular Properties

Compound NameN-[4-(2-ethoxyethoxy)phenyl]-4-propan-2-yloxybenzamide
PubChem CID17130636
Molecular FormulaC20H25NO4
Molecular Weight343.42 g/mol
Exact Mass343.18
IUPAC NameN-[4-(2-ethoxyethoxy)phenyl]-4-propan-2-yloxybenzamide
SMILESCCOCCOc1ccc(NC(=O)c2ccc(OC(C)C)cc2)cc1
InChIInChI=1S/C20H25NO4/c1-4-23-13-14-24-18-11-7-17(8-12-18)21-20(22)16-5-9-19(10-6-16)25-15(2)3/h5-12,15H,4,13-14H2,1-3H3,(H,21,22)
InChIKeyJHLYYGXAQAFOAV-UHFFFAOYSA-N
XLogP4.14
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.42
LogP ≤ 54.14
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

4-(2-ethoxyethoxy)-N-[4-[[4-(2-ethoxyethoxy)benzoyl]amino]phenyl]benzamide
CID 17113406
N-(4-benzamidophenyl)-4-(2-ethoxyethoxy)benzamide
CID 17235471
4-pentoxy-N-(4-propan-2-yloxyphenyl)benzamide
CID 17340246
4-[[4-(2-ethoxyethoxy)benzoyl]amino]-N-(1-phenylethyl)benzamide
CID 43887636
4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide
CID 15943272
N-(3-butan-2-yloxyphenyl)-4-(2-ethoxyethoxy)benzamide
CID 17161659
4-butan-2-yloxy-N-(4-propoxyphenyl)benzamide
CID 17141313
N-[4-(2-(113C)ethoxyethoxy)phenyl]acetamide
CID 54301804
4-[[4-(2-ethoxyethoxy)benzoyl]amino]-N-methyl-N-phenylbenzamide
CID 17230295
N-butan-2-yl-4-[[2-[4-(2-ethoxyethoxy)anilino]acetyl]amino]benzamide
CID 54825625
N-(4-ethoxyphenyl)-4-(2-phenoxyethoxy)benzamide
CID 4952680
N-[[4-(2-ethoxyethoxy)phenyl]carbamothioyl]-4-(2-methoxyethoxy)benzamide
CID 17130787

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-ethoxyethoxy)phenyl]-4-propan-2-yloxybenzamide?
The IUPAC name of N-[4-(2-ethoxyethoxy)phenyl]-4-propan-2-yloxybenzamide (CID 17130636) is N-[4-(2-ethoxyethoxy)phenyl]-4-propan-2-yloxybenzamide.
What is the SMILES notation for N-[4-(2-ethoxyethoxy)phenyl]-4-propan-2-yloxybenzamide?
The canonical SMILES for N-[4-(2-ethoxyethoxy)phenyl]-4-propan-2-yloxybenzamide is CCOCCOc1ccc(NC(=O)c2ccc(OC(C)C)cc2)cc1.
What is the InChIKey of N-[4-(2-ethoxyethoxy)phenyl]-4-propan-2-yloxybenzamide?
The InChIKey is JHLYYGXAQAFOAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO4/c1-4-23-13-14-24-18-11-7-17(8-12-18)21-20(22)16-5-9-19(10-6-16)25-15(2)3/h5-12,15H,4,13-14H2,1-3H3,(H,21,22).
What are the key properties of N-[4-(2-ethoxyethoxy)phenyl]-4-propan-2-yloxybenzamide?
N-[4-(2-ethoxyethoxy)phenyl]-4-propan-2-yloxybenzamide has a molecular weight of 343.42 g/mol, XLogP of 4.14, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-ethoxyethoxy)phenyl]-4-propan-2-yloxybenzamide is sourced from PubChem (CID 17130636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).