2-(3-propan-2-yloxyanilino)-N-(4-propoxyphenyl)acetamide

C20H26N2O3 — CID 54830279

IUPAC2-(3-propan-2-yloxyanilino)-N-(4-propoxyphenyl)acetamide
SMILESCCCOc1ccc(NC(=O)CNc2cccc(OC(C)C)c2)cc1
InChIInChI=1S/C20H26N2O3/c1-4-12-24-18-10-8-16(9-11-18)22-20(23)14-21-17-6-5-7-19(13-17)25-15(2)3/h5-11,13,15,21H,4,12,14H2,1-3H3,(H,22,23)
InChIKeyROVKQQZSERZTLZ-UHFFFAOYSA-N
MW342.44 g/mol
LogP4.31
Rot. Bonds9

About 2-(3-propan-2-yloxyanilino)-N-(4-propoxyphenyl)acetamide

2-(3-propan-2-yloxyanilino)-N-(4-propoxyphenyl)acetamide (PubChem CID 54830279) has the molecular formula C20H26N2O3 and a molecular weight of 342.44 g/mol. Its IUPAC name is 2-(3-propan-2-yloxyanilino)-N-(4-propoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(3-propan-2-yloxyanilino)-N-(4-propoxyphenyl)acetamide
PubChem CID54830279
Molecular FormulaC20H26N2O3
Molecular Weight342.44 g/mol
Exact Mass342.19
IUPAC Name2-(3-propan-2-yloxyanilino)-N-(4-propoxyphenyl)acetamide
SMILESCCCOc1ccc(NC(=O)CNc2cccc(OC(C)C)c2)cc1
InChIInChI=1S/C20H26N2O3/c1-4-12-24-18-10-8-16(9-11-18)22-20(23)14-21-17-6-5-7-19(13-17)25-15(2)3/h5-11,13,15,21H,4,12,14H2,1-3H3,(H,22,23)
InChIKeyROVKQQZSERZTLZ-UHFFFAOYSA-N
XLogP4.31
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 54.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-ethoxyphenyl)-2-(3-propan-2-yloxyanilino)acetamide
CID 54830003
2-(3-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 54829870
2-(4-butoxyanilino)-N-(3-propoxyphenyl)acetamide
CID 54820125
N-(4-methylphenyl)-2-(3-propoxyanilino)acetamide
CID 36860720
2-(3-heptoxyanilino)-N-(3-propan-2-yloxyphenyl)acetamide
CID 54828862
2-(4-propoxyanilino)-N-(4-propoxyphenyl)acetamide
CID 54820383
N-[3-(2-methoxyethoxy)phenyl]-2-(4-propoxyanilino)acetamide
CID 54820051
N-[4-[[2-oxo-2-(3-propan-2-yloxyanilino)ethyl]amino]phenyl]butanamide
CID 54836962
N-(4-butoxyphenyl)-2-[3-(3-methylbutoxy)anilino]acetamide
CID 54824951
2-(3-butoxyanilino)-N-[4-(2-methylpropoxy)phenyl]acetamide
CID 54824959
N-(4-butoxyphenyl)-2-(3-methoxyanilino)acetamide
CID 54814474
N-(3-acetamidophenyl)-2-(4-propoxyanilino)acetamide
CID 54822822

Frequently Asked Questions

What is the IUPAC name of 2-(3-propan-2-yloxyanilino)-N-(4-propoxyphenyl)acetamide?
The IUPAC name of 2-(3-propan-2-yloxyanilino)-N-(4-propoxyphenyl)acetamide (CID 54830279) is 2-(3-propan-2-yloxyanilino)-N-(4-propoxyphenyl)acetamide.
What is the SMILES notation for 2-(3-propan-2-yloxyanilino)-N-(4-propoxyphenyl)acetamide?
The canonical SMILES for 2-(3-propan-2-yloxyanilino)-N-(4-propoxyphenyl)acetamide is CCCOc1ccc(NC(=O)CNc2cccc(OC(C)C)c2)cc1.
What is the InChIKey of 2-(3-propan-2-yloxyanilino)-N-(4-propoxyphenyl)acetamide?
The InChIKey is ROVKQQZSERZTLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3/c1-4-12-24-18-10-8-16(9-11-18)22-20(23)14-21-17-6-5-7-19(13-17)25-15(2)3/h5-11,13,15,21H,4,12,14H2,1-3H3,(H,22,23).
What are the key properties of 2-(3-propan-2-yloxyanilino)-N-(4-propoxyphenyl)acetamide?
2-(3-propan-2-yloxyanilino)-N-(4-propoxyphenyl)acetamide has a molecular weight of 342.44 g/mol, XLogP of 4.31, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-propan-2-yloxyanilino)-N-(4-propoxyphenyl)acetamide is sourced from PubChem (CID 54830279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).