N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-(2-methoxyanilino)acetamide

C15H17N3O3 — CID 5427894

IUPACN-[(Z)-1-(furan-2-yl)ethylideneamino]-2-(2-methoxyanilino)acetamide
SMILESCOc1ccccc1NCC(=O)N/N=C(/C)c1ccco1
InChIInChI=1S/C15H17N3O3/c1-11(13-8-5-9-21-13)17-18-15(19)10-16-12-6-3-4-7-14(12)20-2/h3-9,16H,10H2,1-2H3,(H,18,19)/b17-11-
InChIKeyCGQXAAKTSFRUCP-BOPFTXTBSA-N
MW287.32 g/mol
LogP2.24
Rot. Bonds6

About N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-(2-methoxyanilino)acetamide

N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-(2-methoxyanilino)acetamide (PubChem CID 5427894) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-(2-methoxyanilino)acetamide.

Molecular Properties

Compound NameN-[(Z)-1-(furan-2-yl)ethylideneamino]-2-(2-methoxyanilino)acetamide
PubChem CID5427894
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC NameN-[(Z)-1-(furan-2-yl)ethylideneamino]-2-(2-methoxyanilino)acetamide
SMILESCOc1ccccc1NCC(=O)N/N=C(/C)c1ccco1
InChIInChI=1S/C15H17N3O3/c1-11(13-8-5-9-21-13)17-18-15(19)10-16-12-6-3-4-7-14(12)20-2/h3-9,16H,10H2,1-2H3,(H,18,19)/b17-11-
InChIKeyCGQXAAKTSFRUCP-BOPFTXTBSA-N
XLogP2.24
TPSA75.86 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-[(Z)-1-(furan-2-yl)ethylideneamino]-2-(2-methoxyanilino)acetamide?
The IUPAC name of N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-(2-methoxyanilino)acetamide (CID 5427894) is N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-(2-methoxyanilino)acetamide.
What is the SMILES notation for N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-(2-methoxyanilino)acetamide?
The canonical SMILES for N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-(2-methoxyanilino)acetamide is COc1ccccc1NCC(=O)N/N=C(/C)c1ccco1.
What is the InChIKey of N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-(2-methoxyanilino)acetamide?
The InChIKey is CGQXAAKTSFRUCP-BOPFTXTBSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-11(13-8-5-9-21-13)17-18-15(19)10-16-12-6-3-4-7-14(12)20-2/h3-9,16H,10H2,1-2H3,(H,18,19)/b17-11-.
What are the key properties of N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-(2-methoxyanilino)acetamide?
N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-(2-methoxyanilino)acetamide has a molecular weight of 287.32 g/mol, XLogP of 2.24, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-(2-methoxyanilino)acetamide is sourced from PubChem (CID 5427894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).