N-(3-phenylmethoxy-4-prop-2-enylphenyl)acetamide

C18H19NO2 — CID 18973919

IUPACN-(3-phenylmethoxy-4-prop-2-enylphenyl)acetamide
SMILESC=CCc1ccc(NC(C)=O)cc1OCc1ccccc1
InChIInChI=1S/C18H19NO2/c1-3-7-16-10-11-17(19-14(2)20)12-18(16)21-13-15-8-5-4-6-9-15/h3-6,8-12H,1,7,13H2,2H3,(H,19,20)
InChIKeyFIEPPWSJPUTDLI-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.95
Rot. Bonds6

About N-(3-phenylmethoxy-4-prop-2-enylphenyl)acetamide

N-(3-phenylmethoxy-4-prop-2-enylphenyl)acetamide (PubChem CID 18973919) has the molecular formula C18H19NO2 and a molecular weight of 281.36 g/mol. Its IUPAC name is N-(3-phenylmethoxy-4-prop-2-enylphenyl)acetamide.

Molecular Properties

Compound NameN-(3-phenylmethoxy-4-prop-2-enylphenyl)acetamide
PubChem CID18973919
Molecular FormulaC18H19NO2
Molecular Weight281.36 g/mol
Exact Mass281.14
IUPAC NameN-(3-phenylmethoxy-4-prop-2-enylphenyl)acetamide
SMILESC=CCc1ccc(NC(C)=O)cc1OCc1ccccc1
InChIInChI=1S/C18H19NO2/c1-3-7-16-10-11-17(19-14(2)20)12-18(16)21-13-15-8-5-4-6-9-15/h3-6,8-12H,1,7,13H2,2H3,(H,19,20)
InChIKeyFIEPPWSJPUTDLI-UHFFFAOYSA-N
XLogP3.95
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[3-(4-acetamido-2-phenylmethoxyphenyl)propyl]benzoic acid
CID 67659334
3-phenylmethoxy-4-prop-2-enylphenol
CID 174520142
4-methoxy-2-phenylmethoxy-1-prop-2-enylbenzene
CID 68966556
N-(4-phenylmethoxy-3-propylphenyl)acetamide
CID 57080743
4-oxo-4-(3-prop-2-enoxy-4-prop-2-enylanilino)but-2-enoic acid
CID 57171984
(4-methoxy-3-phenylmethoxyphenyl)carbamic acid
CID 155170089
4-[(2-prop-2-enylphenoxy)methyl]benzoic acid
CID 2252771
4-[(2-carboxybenzoyl)amino]-2-phenylmethoxybenzoic acid
CID 66574423
N-[4-[(2-acetylphenoxy)methyl]phenyl]acetamide
CID 129038120
N-(4-benzamido-3-phenylmethoxyphenyl)benzamide
CID 5314877
2-[[3,4-bis(phenylmethoxy)anilino]methylidene]propanedioic acid
CID 67849323
1-(2-methylprop-2-enoxy)-4-phenylmethoxy-2-prop-2-enylbenzene
CID 175152033

Frequently Asked Questions

What is the IUPAC name of N-(3-phenylmethoxy-4-prop-2-enylphenyl)acetamide?
The IUPAC name of N-(3-phenylmethoxy-4-prop-2-enylphenyl)acetamide (CID 18973919) is N-(3-phenylmethoxy-4-prop-2-enylphenyl)acetamide.
What is the SMILES notation for N-(3-phenylmethoxy-4-prop-2-enylphenyl)acetamide?
The canonical SMILES for N-(3-phenylmethoxy-4-prop-2-enylphenyl)acetamide is C=CCc1ccc(NC(C)=O)cc1OCc1ccccc1.
What is the InChIKey of N-(3-phenylmethoxy-4-prop-2-enylphenyl)acetamide?
The InChIKey is FIEPPWSJPUTDLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO2/c1-3-7-16-10-11-17(19-14(2)20)12-18(16)21-13-15-8-5-4-6-9-15/h3-6,8-12H,1,7,13H2,2H3,(H,19,20).
What are the key properties of N-(3-phenylmethoxy-4-prop-2-enylphenyl)acetamide?
N-(3-phenylmethoxy-4-prop-2-enylphenyl)acetamide has a molecular weight of 281.36 g/mol, XLogP of 3.95, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-phenylmethoxy-4-prop-2-enylphenyl)acetamide is sourced from PubChem (CID 18973919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).