N-cyclohexyl-2,3-diphenylprop-2-enamide

C21H23NO — CID 5060325

IUPACN-cyclohexyl-2,3-diphenylprop-2-enamide
SMILESO=C(NC1CCCCC1)C(=Cc1ccccc1)c1ccccc1
InChIInChI=1S/C21H23NO/c23-21(22-19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)16-17-10-4-1-5-11-17/h1-2,4-7,10-13,16,19H,3,8-9,14-15H2,(H,22,23)
InChIKeyKXGDTWONTACMBC-UHFFFAOYSA-N
MW305.42 g/mol
LogP4.68
Rot. Bonds4

About N-cyclohexyl-2,3-diphenylprop-2-enamide

N-cyclohexyl-2,3-diphenylprop-2-enamide (PubChem CID 5060325) has the molecular formula C21H23NO and a molecular weight of 305.42 g/mol. Its IUPAC name is N-cyclohexyl-2,3-diphenylprop-2-enamide.

Molecular Properties

Compound NameN-cyclohexyl-2,3-diphenylprop-2-enamide
PubChem CID5060325
Molecular FormulaC21H23NO
Molecular Weight305.42 g/mol
Exact Mass305.18
IUPAC NameN-cyclohexyl-2,3-diphenylprop-2-enamide
SMILESO=C(NC1CCCCC1)C(=Cc1ccccc1)c1ccccc1
InChIInChI=1S/C21H23NO/c23-21(22-19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)16-17-10-4-1-5-11-17/h1-2,4-7,10-13,16,19H,3,8-9,14-15H2,(H,22,23)
InChIKeyKXGDTWONTACMBC-UHFFFAOYSA-N
XLogP4.68
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.42
LogP ≤ 54.68
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

(Z)-N-cyclohexyl-2,3-diphenylprop-2-enamide
CID 6260559
3-(4-aminophenyl)-N-cyclododecyl-2-phenylprop-2-enamide
CID 54402620
N-cycloheptyl-3-(4-methoxyphenyl)-2-phenylprop-2-enamide
CID 2930228
N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2,3-diphenylprop-2-enamide
CID 67845558
N-cyclohexyl-2-oxo-2-phenylacetamide
CID 11436176
[4-[(Z)-3-(cyclohexylamino)-3-oxo-2-phenylprop-1-enyl]-2-methoxyphenyl] acetate
CID 67440285
2-acetamido-N-cycloheptyl-3-phenylprop-2-enamide
CID 3677645
N-(2-oxothiolan-3-yl)-2,3-diphenylprop-2-enamide
CID 4287610
N-cyclohexyl-N'-phenyloxamide
CID 2271218
2,3-diphenyl-N-propan-2-ylprop-2-enamide
CID 718287
(E)-2,3-diphenyl-N-propan-2-ylprop-2-enamide
CID 718290
N-[(2Z,4Z)-1-(cyclohexylamino)-1-oxo-5-phenylpenta-2,4-dien-2-yl]benzamide
CID 2232702

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2,3-diphenylprop-2-enamide?
The IUPAC name of N-cyclohexyl-2,3-diphenylprop-2-enamide (CID 5060325) is N-cyclohexyl-2,3-diphenylprop-2-enamide.
What is the SMILES notation for N-cyclohexyl-2,3-diphenylprop-2-enamide?
The canonical SMILES for N-cyclohexyl-2,3-diphenylprop-2-enamide is O=C(NC1CCCCC1)C(=Cc1ccccc1)c1ccccc1.
What is the InChIKey of N-cyclohexyl-2,3-diphenylprop-2-enamide?
The InChIKey is KXGDTWONTACMBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23NO/c23-21(22-19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)16-17-10-4-1-5-11-17/h1-2,4-7,10-13,16,19H,3,8-9,14-15H2,(H,22,23).
What are the key properties of N-cyclohexyl-2,3-diphenylprop-2-enamide?
N-cyclohexyl-2,3-diphenylprop-2-enamide has a molecular weight of 305.42 g/mol, XLogP of 4.68, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2,3-diphenylprop-2-enamide is sourced from PubChem (CID 5060325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).