(Z)-2-acetamido-3-phenyl-N-(2-phenylethyl)prop-2-enamide

C19H20N2O2 — CID 6514464

IUPAC(Z)-2-acetamido-3-phenyl-N-(2-phenylethyl)prop-2-enamide
SMILESCC(=O)N/C(=C\c1ccccc1)C(=O)NCCc1ccccc1
InChIInChI=1S/C19H20N2O2/c1-15(22)21-18(14-17-10-6-3-7-11-17)19(23)20-13-12-16-8-4-2-5-9-16/h2-11,14H,12-13H2,1H3,(H,20,23)(H,21,22)/b18-14-
InChIKeyILTSMWWJBSDPOA-JXAWBTAJSA-N
MW308.38 g/mol
LogP2.52
Rot. Bonds6

About (Z)-2-acetamido-3-phenyl-N-(2-phenylethyl)prop-2-enamide

(Z)-2-acetamido-3-phenyl-N-(2-phenylethyl)prop-2-enamide (PubChem CID 6514464) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is (Z)-2-acetamido-3-phenyl-N-(2-phenylethyl)prop-2-enamide.

Molecular Properties

Compound Name(Z)-2-acetamido-3-phenyl-N-(2-phenylethyl)prop-2-enamide
PubChem CID6514464
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name(Z)-2-acetamido-3-phenyl-N-(2-phenylethyl)prop-2-enamide
SMILESCC(=O)N/C(=C\c1ccccc1)C(=O)NCCc1ccccc1
InChIInChI=1S/C19H20N2O2/c1-15(22)21-18(14-17-10-6-3-7-11-17)19(23)20-13-12-16-8-4-2-5-9-16/h2-11,14H,12-13H2,1H3,(H,20,23)(H,21,22)/b18-14-
InChIKeyILTSMWWJBSDPOA-JXAWBTAJSA-N
XLogP2.52
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-acetamido-3-phenyl-N-(2-phenylethyl)prop-2-enamide?
The IUPAC name of (Z)-2-acetamido-3-phenyl-N-(2-phenylethyl)prop-2-enamide (CID 6514464) is (Z)-2-acetamido-3-phenyl-N-(2-phenylethyl)prop-2-enamide.
What is the SMILES notation for (Z)-2-acetamido-3-phenyl-N-(2-phenylethyl)prop-2-enamide?
The canonical SMILES for (Z)-2-acetamido-3-phenyl-N-(2-phenylethyl)prop-2-enamide is CC(=O)N/C(=C\c1ccccc1)C(=O)NCCc1ccccc1.
What is the InChIKey of (Z)-2-acetamido-3-phenyl-N-(2-phenylethyl)prop-2-enamide?
The InChIKey is ILTSMWWJBSDPOA-JXAWBTAJSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-15(22)21-18(14-17-10-6-3-7-11-17)19(23)20-13-12-16-8-4-2-5-9-16/h2-11,14H,12-13H2,1H3,(H,20,23)(H,21,22)/b18-14-.
What are the key properties of (Z)-2-acetamido-3-phenyl-N-(2-phenylethyl)prop-2-enamide?
(Z)-2-acetamido-3-phenyl-N-(2-phenylethyl)prop-2-enamide has a molecular weight of 308.38 g/mol, XLogP of 2.52, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-acetamido-3-phenyl-N-(2-phenylethyl)prop-2-enamide is sourced from PubChem (CID 6514464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).