2-(4-fluorophenyl)-N,N-bis(prop-2-enyl)acetamide

C14H16FNO — CID 798734

IUPAC2-(4-fluorophenyl)-N,N-bis(prop-2-enyl)acetamide
SMILESC=CCN(CC=C)C(=O)Cc1ccc(F)cc1
InChIInChI=1S/C14H16FNO/c1-3-9-16(10-4-2)14(17)11-12-5-7-13(15)8-6-12/h3-8H,1-2,9-11H2
InChIKeyOAGMCSCEMFCFAM-UHFFFAOYSA-N
MW233.29 g/mol
LogP2.57
Rot. Bonds6

About 2-(4-fluorophenyl)-N,N-bis(prop-2-enyl)acetamide

2-(4-fluorophenyl)-N,N-bis(prop-2-enyl)acetamide (PubChem CID 798734) has the molecular formula C14H16FNO and a molecular weight of 233.29 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N,N-bis(prop-2-enyl)acetamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N,N-bis(prop-2-enyl)acetamide
PubChem CID798734
Molecular FormulaC14H16FNO
Molecular Weight233.29 g/mol
Exact Mass233.12
IUPAC Name2-(4-fluorophenyl)-N,N-bis(prop-2-enyl)acetamide
SMILESC=CCN(CC=C)C(=O)Cc1ccc(F)cc1
InChIInChI=1S/C14H16FNO/c1-3-9-16(10-4-2)14(17)11-12-5-7-13(15)8-6-12/h3-8H,1-2,9-11H2
InChIKeyOAGMCSCEMFCFAM-UHFFFAOYSA-N
XLogP2.57
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.29
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 17076
N,N-Diethylbenzamide
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N-Cyclohexyl-2-phenylacetamide
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1-Benzylazepan-2-one
CID 1491068
(9Z,12Z,15Z)-N-(2-phenylethyl)octadeca-9,12,15-trienamide
CID 155618148
1-(2,6-Difluorobenzoyl)pyrrolidine
CID 588246
N-(pentan-2-yl)-2-phenylacetamide
CID 2886843
N-Acetylmethamphetamine
CID 526655
N,N-Dibutylbenzamide
CID 32774
N,N-Dimethyl-2-phenylacetamide
CID 87853
N-phenethyl-2-phenylacetamide
CID 138516
1-(4-Ethylpiperazin-1-yl)-2-phenylethanone
CID 3328378

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N,N-bis(prop-2-enyl)acetamide?
The IUPAC name of 2-(4-fluorophenyl)-N,N-bis(prop-2-enyl)acetamide (CID 798734) is 2-(4-fluorophenyl)-N,N-bis(prop-2-enyl)acetamide.
What is the SMILES notation for 2-(4-fluorophenyl)-N,N-bis(prop-2-enyl)acetamide?
The canonical SMILES for 2-(4-fluorophenyl)-N,N-bis(prop-2-enyl)acetamide is C=CCN(CC=C)C(=O)Cc1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-N,N-bis(prop-2-enyl)acetamide?
The InChIKey is OAGMCSCEMFCFAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FNO/c1-3-9-16(10-4-2)14(17)11-12-5-7-13(15)8-6-12/h3-8H,1-2,9-11H2.
What are the key properties of 2-(4-fluorophenyl)-N,N-bis(prop-2-enyl)acetamide?
2-(4-fluorophenyl)-N,N-bis(prop-2-enyl)acetamide has a molecular weight of 233.29 g/mol, XLogP of 2.57, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N,N-bis(prop-2-enyl)acetamide is sourced from PubChem (CID 798734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).