N-(2-acetamido-4-phenoxy-3-prop-2-enylphenyl)acetamide

C19H20N2O3 — CID 70450631

IUPACN-(2-acetamido-4-phenoxy-3-prop-2-enylphenyl)acetamide
SMILESC=CCc1c(Oc2ccccc2)ccc(NC(C)=O)c1NC(C)=O
InChIInChI=1S/C19H20N2O3/c1-4-8-16-18(24-15-9-6-5-7-10-15)12-11-17(20-13(2)22)19(16)21-14(3)23/h4-7,9-12H,1,8H2,2-3H3,(H,20,22)(H,21,23)
InChIKeySLDWGSYBVNBVCE-UHFFFAOYSA-N
MW324.38 g/mol
LogP4.12
Rot. Bonds6

About N-(2-acetamido-4-phenoxy-3-prop-2-enylphenyl)acetamide

N-(2-acetamido-4-phenoxy-3-prop-2-enylphenyl)acetamide (PubChem CID 70450631) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is N-(2-acetamido-4-phenoxy-3-prop-2-enylphenyl)acetamide.

Molecular Properties

Compound NameN-(2-acetamido-4-phenoxy-3-prop-2-enylphenyl)acetamide
PubChem CID70450631
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC NameN-(2-acetamido-4-phenoxy-3-prop-2-enylphenyl)acetamide
SMILESC=CCc1c(Oc2ccccc2)ccc(NC(C)=O)c1NC(C)=O
InChIInChI=1S/C19H20N2O3/c1-4-8-16-18(24-15-9-6-5-7-10-15)12-11-17(20-13(2)22)19(16)21-14(3)23/h4-7,9-12H,1,8H2,2-3H3,(H,20,22)(H,21,23)
InChIKeySLDWGSYBVNBVCE-UHFFFAOYSA-N
XLogP4.12
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[4-(4-methyl-2-prop-2-enylphenoxy)phenyl]acetamide
CID 54371897
N-(2-phenoxyphenyl)-2-(prop-2-enylamino)acetamide
CID 78908251
phenoxybenzene;N-phenylacetamide
CID 174350344
N-[4-(3-bromopropoxy)-3-prop-2-enyl-2-(trifluoromethyl)phenyl]acetamide
CID 67577859
(2-acetamido-6-phenoxyphenyl) butanoate
CID 175184242
1-isocyanato-3-phenoxy-2-prop-2-enylbenzene
CID 88668442
N-[2-(2-phenoxyanilino)ethyl]acetamide
CID 103604146
2-(2-phenoxyanilino)-N-prop-2-enylacetamide
CID 108992999
molecular nitrogen;1-phenoxy-2-prop-2-enylbenzene
CID 70452460
N-(2-ethenoxyphenyl)acetamide
CID 66367179
N-[2-(2-prop-2-enoxyethoxy)phenyl]acetamide
CID 86096394
N-[2-methoxy-5-[(2-phenoxyphenyl)sulfamoyl]phenyl]acetamide
CID 71903158

Frequently Asked Questions

What is the IUPAC name of N-(2-acetamido-4-phenoxy-3-prop-2-enylphenyl)acetamide?
The IUPAC name of N-(2-acetamido-4-phenoxy-3-prop-2-enylphenyl)acetamide (CID 70450631) is N-(2-acetamido-4-phenoxy-3-prop-2-enylphenyl)acetamide.
What is the SMILES notation for N-(2-acetamido-4-phenoxy-3-prop-2-enylphenyl)acetamide?
The canonical SMILES for N-(2-acetamido-4-phenoxy-3-prop-2-enylphenyl)acetamide is C=CCc1c(Oc2ccccc2)ccc(NC(C)=O)c1NC(C)=O.
What is the InChIKey of N-(2-acetamido-4-phenoxy-3-prop-2-enylphenyl)acetamide?
The InChIKey is SLDWGSYBVNBVCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-4-8-16-18(24-15-9-6-5-7-10-15)12-11-17(20-13(2)22)19(16)21-14(3)23/h4-7,9-12H,1,8H2,2-3H3,(H,20,22)(H,21,23).
What are the key properties of N-(2-acetamido-4-phenoxy-3-prop-2-enylphenyl)acetamide?
N-(2-acetamido-4-phenoxy-3-prop-2-enylphenyl)acetamide has a molecular weight of 324.38 g/mol, XLogP of 4.12, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetamido-4-phenoxy-3-prop-2-enylphenyl)acetamide is sourced from PubChem (CID 70450631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).