N-(1-benzofuran-2-ylmethoxy)methanimine

C10H9NO2 — CID 174418937

IUPACN-(1-benzofuran-2-ylmethoxy)methanimine
SMILESC=NOCc1cc2ccccc2o1
InChIInChI=1S/C10H9NO2/c1-11-12-7-9-6-8-4-2-3-5-10(8)13-9/h2-6H,1,7H2
InChIKeyOGAPMDJFGQMFCC-UHFFFAOYSA-N
MW175.19 g/mol
LogP2.57
Rot. Bonds3

About N-(1-benzofuran-2-ylmethoxy)methanimine

N-(1-benzofuran-2-ylmethoxy)methanimine (PubChem CID 174418937) has the molecular formula C10H9NO2 and a molecular weight of 175.19 g/mol. Its IUPAC name is N-(1-benzofuran-2-ylmethoxy)methanimine.

Molecular Properties

Compound NameN-(1-benzofuran-2-ylmethoxy)methanimine
PubChem CID174418937
Molecular FormulaC10H9NO2
Molecular Weight175.19 g/mol
Exact Mass175.06
IUPAC NameN-(1-benzofuran-2-ylmethoxy)methanimine
SMILESC=NOCc1cc2ccccc2o1
InChIInChI=1S/C10H9NO2/c1-11-12-7-9-6-8-4-2-3-5-10(8)13-9/h2-6H,1,7H2
InChIKeyOGAPMDJFGQMFCC-UHFFFAOYSA-N
XLogP2.57
TPSA34.73 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 52.57
H-Bond Donors ≤ 50
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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Related Compounds

2-(1-benzofuran-2-ylmethoxymethyl)-1-benzofuran
CID 151118650
1-benzofuran-2-ylmethyl formate
CID 18617223
1-benzofuran-2-ylmethoxy-tert-butyl-dimethylsilane
CID 135029239
CID 156725408
CID 156725408
1-benzofuran-2-ylmethoxysulfanylmethyl-deuterio-tritioborane
CID 161037358
1-benzofuran-2-ylmethyl 2-ethylbutanoate
CID 86918284
1-benzofuran-2-ylmethyl 4-acetylbenzoate
CID 86933494
2-[(2-methoxyphenyl)methyl]-1-benzofuran
CID 21435281
2-decyl-1-benzofuran
CID 15365265
1-benzofuran-2-ylmethyl 2-(4-fluorophenoxy)acetate
CID 134026431
1-benzofuran-2-ylmethyl 4-(methoxymethyl)benzoate
CID 34155031
N-(1-benzofuran-2-ylmethyl)-2-ethylsulfinylethanamine
CID 113237590

Frequently Asked Questions

What is the IUPAC name of N-(1-benzofuran-2-ylmethoxy)methanimine?
The IUPAC name of N-(1-benzofuran-2-ylmethoxy)methanimine (CID 174418937) is N-(1-benzofuran-2-ylmethoxy)methanimine.
What is the SMILES notation for N-(1-benzofuran-2-ylmethoxy)methanimine?
The canonical SMILES for N-(1-benzofuran-2-ylmethoxy)methanimine is C=NOCc1cc2ccccc2o1.
What is the InChIKey of N-(1-benzofuran-2-ylmethoxy)methanimine?
The InChIKey is OGAPMDJFGQMFCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO2/c1-11-12-7-9-6-8-4-2-3-5-10(8)13-9/h2-6H,1,7H2.
What are the key properties of N-(1-benzofuran-2-ylmethoxy)methanimine?
N-(1-benzofuran-2-ylmethoxy)methanimine has a molecular weight of 175.19 g/mol, XLogP of 2.57, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzofuran-2-ylmethoxy)methanimine is sourced from PubChem (CID 174418937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).