N-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-phenylacetamide

C15H14N2O2 — CID 6895097

IUPACN-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)N/N=C/C=C/c1ccco1
InChIInChI=1S/C15H14N2O2/c18-15(12-13-6-2-1-3-7-13)17-16-10-4-8-14-9-5-11-19-14/h1-11H,12H2,(H,17,18)/b8-4+,16-10+
InChIKeyKNVAREUGKDGMHT-PVZXKMMOSA-N
MW254.29 g/mol
LogP2.64
Rot. Bonds5

About N-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-phenylacetamide

N-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-phenylacetamide (PubChem CID 6895097) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is N-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-phenylacetamide.

Molecular Properties

Compound NameN-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-phenylacetamide
PubChem CID6895097
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC NameN-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)N/N=C/C=C/c1ccco1
InChIInChI=1S/C15H14N2O2/c18-15(12-13-6-2-1-3-7-13)17-16-10-4-8-14-9-5-11-19-14/h1-11H,12H2,(H,17,18)/b8-4+,16-10+
InChIKeyKNVAREUGKDGMHT-PVZXKMMOSA-N
XLogP2.64
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-phenylacetamide?
The IUPAC name of N-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-phenylacetamide (CID 6895097) is N-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-phenylacetamide.
What is the SMILES notation for N-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-phenylacetamide?
The canonical SMILES for N-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-phenylacetamide is O=C(Cc1ccccc1)N/N=C/C=C/c1ccco1.
What is the InChIKey of N-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-phenylacetamide?
The InChIKey is KNVAREUGKDGMHT-PVZXKMMOSA-N. The full InChI is InChI=1S/C15H14N2O2/c18-15(12-13-6-2-1-3-7-13)17-16-10-4-8-14-9-5-11-19-14/h1-11H,12H2,(H,17,18)/b8-4+,16-10+.
What are the key properties of N-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-phenylacetamide?
N-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-phenylacetamide has a molecular weight of 254.29 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-phenylacetamide is sourced from PubChem (CID 6895097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).