N-[(5-methylfuran-2-yl)methylideneamino]-2-(2-methylphenoxy)acetamide

C15H16N2O3 — CID 758393

IUPACN-[(5-methylfuran-2-yl)methylideneamino]-2-(2-methylphenoxy)acetamide
SMILESCc1ccc(C=NNC(=O)COc2ccccc2C)o1
InChIInChI=1S/C15H16N2O3/c1-11-5-3-4-6-14(11)19-10-15(18)17-16-9-13-8-7-12(2)20-13/h3-9H,10H2,1-2H3,(H,17,18)
InChIKeyDPYCDNBIJYYADW-UHFFFAOYSA-N
MW272.30 g/mol
LogP2.43
Rot. Bonds5

About N-[(5-methylfuran-2-yl)methylideneamino]-2-(2-methylphenoxy)acetamide

N-[(5-methylfuran-2-yl)methylideneamino]-2-(2-methylphenoxy)acetamide (PubChem CID 758393) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is N-[(5-methylfuran-2-yl)methylideneamino]-2-(2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[(5-methylfuran-2-yl)methylideneamino]-2-(2-methylphenoxy)acetamide
PubChem CID758393
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC NameN-[(5-methylfuran-2-yl)methylideneamino]-2-(2-methylphenoxy)acetamide
SMILESCc1ccc(C=NNC(=O)COc2ccccc2C)o1
InChIInChI=1S/C15H16N2O3/c1-11-5-3-4-6-14(11)19-10-15(18)17-16-9-13-8-7-12(2)20-13/h3-9H,10H2,1-2H3,(H,17,18)
InChIKeyDPYCDNBIJYYADW-UHFFFAOYSA-N
XLogP2.43
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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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Related Compounds

N-[(5-methylfuran-2-yl)methylideneamino]-2-phenoxyacetamide
CID 913599
N-[(E)-(4-methoxyphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide
CID 6870806
2-(2-methylphenoxy)-N-[(5-pyridin-2-ylsulfanylfuran-2-yl)methylideneamino]acetamide
CID 1040366
4-[[[2-(2-methylphenoxy)acetyl]hydrazinylidene]methyl]benzoic acid
CID 784771
5-[[[2-(2,3-dimethylphenoxy)acetyl]hydrazinylidene]methyl]furan-2-sulfonic acid
CID 4220503
2-(2,6-dimethyl-4-nitrophenoxy)-N-[(5-methylfuran-2-yl)methylideneamino]acetamide
CID 834047
N-[(2,4-dimethoxyphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide
CID 831096
2-(2-methylphenoxy)-N-[(Z)-(2,4,5-trimethoxyphenyl)methylideneamino]acetamide
CID 5456697
2-(2-methylphenoxy)-N-[(2-prop-2-enoxyphenyl)methylideneamino]acetamide
CID 2251128
N-[(E)-(5-methylfuran-2-yl)methylideneamino]-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 42991542
[4-[(Z)-[[2-(2-methylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 4-methylbenzoate
CID 6025641
N-[(Z)-(2,4-dihydroxy-6-methylphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide
CID 136794053

Frequently Asked Questions

What is the IUPAC name of N-[(5-methylfuran-2-yl)methylideneamino]-2-(2-methylphenoxy)acetamide?
The IUPAC name of N-[(5-methylfuran-2-yl)methylideneamino]-2-(2-methylphenoxy)acetamide (CID 758393) is N-[(5-methylfuran-2-yl)methylideneamino]-2-(2-methylphenoxy)acetamide.
What is the SMILES notation for N-[(5-methylfuran-2-yl)methylideneamino]-2-(2-methylphenoxy)acetamide?
The canonical SMILES for N-[(5-methylfuran-2-yl)methylideneamino]-2-(2-methylphenoxy)acetamide is Cc1ccc(C=NNC(=O)COc2ccccc2C)o1.
What is the InChIKey of N-[(5-methylfuran-2-yl)methylideneamino]-2-(2-methylphenoxy)acetamide?
The InChIKey is DPYCDNBIJYYADW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c1-11-5-3-4-6-14(11)19-10-15(18)17-16-9-13-8-7-12(2)20-13/h3-9H,10H2,1-2H3,(H,17,18).
What are the key properties of N-[(5-methylfuran-2-yl)methylideneamino]-2-(2-methylphenoxy)acetamide?
N-[(5-methylfuran-2-yl)methylideneamino]-2-(2-methylphenoxy)acetamide has a molecular weight of 272.30 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methylfuran-2-yl)methylideneamino]-2-(2-methylphenoxy)acetamide is sourced from PubChem (CID 758393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).