N-[(2,5-dimethoxyphenyl)methylideneamino]-2-methylfuran-3-carboxamide

C15H16N2O4 — CID 760358

IUPACN-[(2,5-dimethoxyphenyl)methylideneamino]-2-methylfuran-3-carboxamide
SMILESCOc1ccc(OC)c(C=NNC(=O)c2ccoc2C)c1
InChIInChI=1S/C15H16N2O4/c1-10-13(6-7-21-10)15(18)17-16-9-11-8-12(19-2)4-5-14(11)20-3/h4-9H,1-3H3,(H,17,18)
InChIKeyMJBXGIMMABBIAX-UHFFFAOYSA-N
MW288.30 g/mol
LogP2.37
Rot. Bonds5

About N-[(2,5-dimethoxyphenyl)methylideneamino]-2-methylfuran-3-carboxamide

N-[(2,5-dimethoxyphenyl)methylideneamino]-2-methylfuran-3-carboxamide (PubChem CID 760358) has the molecular formula C15H16N2O4 and a molecular weight of 288.30 g/mol. Its IUPAC name is N-[(2,5-dimethoxyphenyl)methylideneamino]-2-methylfuran-3-carboxamide.

Molecular Properties

Compound NameN-[(2,5-dimethoxyphenyl)methylideneamino]-2-methylfuran-3-carboxamide
PubChem CID760358
Molecular FormulaC15H16N2O4
Molecular Weight288.30 g/mol
Exact Mass288.11
IUPAC NameN-[(2,5-dimethoxyphenyl)methylideneamino]-2-methylfuran-3-carboxamide
SMILESCOc1ccc(OC)c(C=NNC(=O)c2ccoc2C)c1
InChIInChI=1S/C15H16N2O4/c1-10-13(6-7-21-10)15(18)17-16-9-11-8-12(19-2)4-5-14(11)20-3/h4-9H,1-3H3,(H,17,18)
InChIKeyMJBXGIMMABBIAX-UHFFFAOYSA-N
XLogP2.37
TPSA73.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.30
LogP ≤ 52.37
H-Bond Donors ≤ 51
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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Related Compounds

2-methyl-N-[(2,3,4-trimethoxyphenyl)methylideneamino]furan-3-carboxamide
CID 847605
N-[(2,5-dimethoxyphenyl)methylideneamino]-2-methoxy-4-methylbenzamide
CID 4304772
N-[(4-methoxynaphthalen-1-yl)methylideneamino]-2-methylfuran-3-carboxamide
CID 932462
N-[(Z)-(4-hydroxy-3,5-dimethoxyphenyl)methylideneamino]-2-methylfuran-3-carboxamide
CID 136851848
N-[(2,5-dimethoxyphenyl)methylideneamino]-4-hydroxybenzamide
CID 4193667
N-[(3-bromo-4-methoxyphenyl)methylideneamino]-2-methylfuran-3-carboxamide
CID 761682
2-chloro-N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]-4-methylbenzamide
CID 7373594
methyl N-[(2,5-dimethoxyphenyl)methylideneamino]carbamate
CID 5087461
2,4-dichloro-N-[(2,5-dimethoxyphenyl)methylideneamino]benzamide
CID 3623191
N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]-3-methoxybenzamide
CID 6026549
N'-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]-N-methyloxamide
CID 126140196
N-[(2,4-dimethoxyphenyl)methylideneamino]-2,5-dimethylfuran-3-carboxamide
CID 760422

Frequently Asked Questions

What is the IUPAC name of N-[(2,5-dimethoxyphenyl)methylideneamino]-2-methylfuran-3-carboxamide?
The IUPAC name of N-[(2,5-dimethoxyphenyl)methylideneamino]-2-methylfuran-3-carboxamide (CID 760358) is N-[(2,5-dimethoxyphenyl)methylideneamino]-2-methylfuran-3-carboxamide.
What is the SMILES notation for N-[(2,5-dimethoxyphenyl)methylideneamino]-2-methylfuran-3-carboxamide?
The canonical SMILES for N-[(2,5-dimethoxyphenyl)methylideneamino]-2-methylfuran-3-carboxamide is COc1ccc(OC)c(C=NNC(=O)c2ccoc2C)c1.
What is the InChIKey of N-[(2,5-dimethoxyphenyl)methylideneamino]-2-methylfuran-3-carboxamide?
The InChIKey is MJBXGIMMABBIAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O4/c1-10-13(6-7-21-10)15(18)17-16-9-11-8-12(19-2)4-5-14(11)20-3/h4-9H,1-3H3,(H,17,18).
What are the key properties of N-[(2,5-dimethoxyphenyl)methylideneamino]-2-methylfuran-3-carboxamide?
N-[(2,5-dimethoxyphenyl)methylideneamino]-2-methylfuran-3-carboxamide has a molecular weight of 288.30 g/mol, XLogP of 2.37, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,5-dimethoxyphenyl)methylideneamino]-2-methylfuran-3-carboxamide is sourced from PubChem (CID 760358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).