N-ethyl-3-(4-methylphenyl)-N-phenylprop-2-enamide

C18H19NO — CID 917661

IUPACN-ethyl-3-(4-methylphenyl)-N-phenylprop-2-enamide
SMILESCCN(C(=O)C=Cc1ccc(C)cc1)c1ccccc1
InChIInChI=1S/C18H19NO/c1-3-19(17-7-5-4-6-8-17)18(20)14-13-16-11-9-15(2)10-12-16/h4-14H,3H2,1-2H3
InChIKeyWKWQWBKHPPWROO-UHFFFAOYSA-N
MW265.36 g/mol
LogP4.06
Rot. Bonds4

About N-ethyl-3-(4-methylphenyl)-N-phenylprop-2-enamide

N-ethyl-3-(4-methylphenyl)-N-phenylprop-2-enamide (PubChem CID 917661) has the molecular formula C18H19NO and a molecular weight of 265.36 g/mol. Its IUPAC name is N-ethyl-3-(4-methylphenyl)-N-phenylprop-2-enamide.

Molecular Properties

Compound NameN-ethyl-3-(4-methylphenyl)-N-phenylprop-2-enamide
PubChem CID917661
Molecular FormulaC18H19NO
Molecular Weight265.36 g/mol
Exact Mass265.15
IUPAC NameN-ethyl-3-(4-methylphenyl)-N-phenylprop-2-enamide
SMILESCCN(C(=O)C=Cc1ccc(C)cc1)c1ccccc1
InChIInChI=1S/C18H19NO/c1-3-19(17-7-5-4-6-8-17)18(20)14-13-16-11-9-15(2)10-12-16/h4-14H,3H2,1-2H3
InChIKeyWKWQWBKHPPWROO-UHFFFAOYSA-N
XLogP4.06
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

(E)-3-(4-methylphenyl)-N-phenyl-N-propylprop-2-enamide
CID 126607669
(E)-3-(3-amino-4-methylphenyl)-N-ethyl-N-phenylprop-2-enamide
CID 39380514
(E)-3-[4-(diethylsulfamoyl)phenyl]-N-ethyl-N-phenylprop-2-enamide
CID 16558543
(E)-N-ethyl-3-(4-hydroxyphenyl)-N-(3-methylphenyl)prop-2-enamide
CID 84552695
(E)-3-(4-chlorophenyl)-N-[2-(N-[(E)-3-(4-chlorophenyl)prop-2-enoyl]anilino)ethyl]-N-phenylprop-2-enamide
CID 17195945
N-ethyl-N-(2-iodophenyl)-3-phenylprop-2-enamide
CID 165178394
(1E,4E)-1-(4-methylphenyl)-5-phenylpenta-1,4-dien-3-one
CID 6175900
(E)-3-(4-methylphenyl)-N-phenyl-N-pyridin-2-ylprop-2-enamide
CID 53234949
3-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]prop-2-enoic acid
CID 123339824
(E)-N-(4-methylphenyl)sulfonyl-N-phenyl-3-(4-propoxyphenyl)prop-2-enamide
CID 19212222
(E)-N-ethyl-N-(3-methylphenyl)-3-[3-(trifluoromethyl)phenyl]prop-2-enamide
CID 5353234
4-methyl-N-[4-[(E)-2-[4-[(E)-2-[4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]phenyl]ethenyl]phenyl]-N-phenylaniline
CID 14366502

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(4-methylphenyl)-N-phenylprop-2-enamide?
The IUPAC name of N-ethyl-3-(4-methylphenyl)-N-phenylprop-2-enamide (CID 917661) is N-ethyl-3-(4-methylphenyl)-N-phenylprop-2-enamide.
What is the SMILES notation for N-ethyl-3-(4-methylphenyl)-N-phenylprop-2-enamide?
The canonical SMILES for N-ethyl-3-(4-methylphenyl)-N-phenylprop-2-enamide is CCN(C(=O)C=Cc1ccc(C)cc1)c1ccccc1.
What is the InChIKey of N-ethyl-3-(4-methylphenyl)-N-phenylprop-2-enamide?
The InChIKey is WKWQWBKHPPWROO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO/c1-3-19(17-7-5-4-6-8-17)18(20)14-13-16-11-9-15(2)10-12-16/h4-14H,3H2,1-2H3.
What are the key properties of N-ethyl-3-(4-methylphenyl)-N-phenylprop-2-enamide?
N-ethyl-3-(4-methylphenyl)-N-phenylprop-2-enamide has a molecular weight of 265.36 g/mol, XLogP of 4.06, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(4-methylphenyl)-N-phenylprop-2-enamide is sourced from PubChem (CID 917661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).