2,3-diphenyl-N-propan-2-ylprop-2-enamide

C18H19NO — CID 718287

IUPAC2,3-diphenyl-N-propan-2-ylprop-2-enamide
SMILESCC(C)NC(=O)C(=Cc1ccccc1)c1ccccc1
InChIInChI=1S/C18H19NO/c1-14(2)19-18(20)17(16-11-7-4-8-12-16)13-15-9-5-3-6-10-15/h3-14H,1-2H3,(H,19,20)
InChIKeyMAVLOCUHSSXSND-UHFFFAOYSA-N
MW265.36 g/mol
LogP3.75
Rot. Bonds4

About 2,3-diphenyl-N-propan-2-ylprop-2-enamide

2,3-diphenyl-N-propan-2-ylprop-2-enamide (PubChem CID 718287) has the molecular formula C18H19NO and a molecular weight of 265.36 g/mol. Its IUPAC name is 2,3-diphenyl-N-propan-2-ylprop-2-enamide.

Molecular Properties

Compound Name2,3-diphenyl-N-propan-2-ylprop-2-enamide
PubChem CID718287
Molecular FormulaC18H19NO
Molecular Weight265.36 g/mol
Exact Mass265.15
IUPAC Name2,3-diphenyl-N-propan-2-ylprop-2-enamide
SMILESCC(C)NC(=O)C(=Cc1ccccc1)c1ccccc1
InChIInChI=1S/C18H19NO/c1-14(2)19-18(20)17(16-11-7-4-8-12-16)13-15-9-5-3-6-10-15/h3-14H,1-2H3,(H,19,20)
InChIKeyMAVLOCUHSSXSND-UHFFFAOYSA-N
XLogP3.75
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(E)-2,3-diphenyl-N-propan-2-ylprop-2-enamide
CID 718290
(E)-N-(3-methylbutan-2-yl)-2,3-diphenylprop-2-enamide
CID 133240414
4-methyl-1,2-diphenylpent-1-en-3-one
CID 54502058
(E)-N-[(1S)-1-(2,4-dimethylphenyl)ethyl]-2,3-diphenylprop-2-enamide
CID 92683153
(Z)-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-2,3-diphenylprop-2-enamide
CID 108760126
methyl 3-[[(E)-2,3-diphenylprop-2-enoyl]amino]propanoate
CID 102534464
(E)-N-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]-2,3-diphenylprop-2-enamide
CID 99959671
ethyl 2-(2,3-diphenylprop-2-enoylamino)acetate
CID 4270908
N-cyclohexyl-2,3-diphenylprop-2-enamide
CID 5060325
(Z)-N-cyclohexyl-2,3-diphenylprop-2-enamide
CID 6260559
(E)-N-(2-methoxyethyl)-2,3-diphenylprop-2-enamide
CID 19174350
2,3-diphenyl-N-(2-phenylethyl)prop-2-enamide
CID 2897013

Frequently Asked Questions

What is the IUPAC name of 2,3-diphenyl-N-propan-2-ylprop-2-enamide?
The IUPAC name of 2,3-diphenyl-N-propan-2-ylprop-2-enamide (CID 718287) is 2,3-diphenyl-N-propan-2-ylprop-2-enamide.
What is the SMILES notation for 2,3-diphenyl-N-propan-2-ylprop-2-enamide?
The canonical SMILES for 2,3-diphenyl-N-propan-2-ylprop-2-enamide is CC(C)NC(=O)C(=Cc1ccccc1)c1ccccc1.
What is the InChIKey of 2,3-diphenyl-N-propan-2-ylprop-2-enamide?
The InChIKey is MAVLOCUHSSXSND-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO/c1-14(2)19-18(20)17(16-11-7-4-8-12-16)13-15-9-5-3-6-10-15/h3-14H,1-2H3,(H,19,20).
What are the key properties of 2,3-diphenyl-N-propan-2-ylprop-2-enamide?
2,3-diphenyl-N-propan-2-ylprop-2-enamide has a molecular weight of 265.36 g/mol, XLogP of 3.75, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diphenyl-N-propan-2-ylprop-2-enamide is sourced from PubChem (CID 718287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).