4-(furan-2-ylmethylideneamino)-N,N-dimethylaniline

C13H14N2O — CID 781698

IUPAC4-(furan-2-ylmethylideneamino)-N,N-dimethylaniline
SMILESCN(C)c1ccc(/N=C/c2ccco2)cc1
InChIInChI=1S/C13H14N2O/c1-15(2)12-7-5-11(6-8-12)14-10-13-4-3-9-16-13/h3-10H,1-2H3/b14-10+
InChIKeyJRYZHBZAMKMHEZ-GXDHUFHOSA-N
MW214.27 g/mol
LogP3.10
Rot. Bonds3

About 4-(furan-2-ylmethylideneamino)-N,N-dimethylaniline

4-(furan-2-ylmethylideneamino)-N,N-dimethylaniline (PubChem CID 781698) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 4-(furan-2-ylmethylideneamino)-N,N-dimethylaniline.

Molecular Properties

Compound Name4-(furan-2-ylmethylideneamino)-N,N-dimethylaniline
PubChem CID781698
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name4-(furan-2-ylmethylideneamino)-N,N-dimethylaniline
SMILESCN(C)c1ccc(/N=C/c2ccco2)cc1
InChIInChI=1S/C13H14N2O/c1-15(2)12-7-5-11(6-8-12)14-10-13-4-3-9-16-13/h3-10H,1-2H3/b14-10+
InChIKeyJRYZHBZAMKMHEZ-GXDHUFHOSA-N
XLogP3.10
TPSA28.74 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-(Furfurylidene)-P-anisidine
CID 778756
(E)-4-((furan-2-ylmethylene)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one
CID 624533
N-[(E,2E)-3-(2-furyl)-2-methyl-2-propenylidene]-4-phenyl-1-piperazinamine
CID 6880130
N-Furfurylidene-M-toluidine
CID 5046711
N,N-dimethyl-4-[(5-methylfuran-2-yl)methylideneamino]aniline
CID 781700
N~1~,N~1~-diethyl-N~4~-[(5-nitro-2-furyl)methylene]-1,4-benzenediamine
CID 832284
(1-Furan-2-yl-ethylidene)-(4-phenyl-piperazin-1-yl)-amine
CID 5344506
(E)-N-((Z)-3-(furan-2-yl)-2-methylallylidene)-4-phenylpiperazin-1-amine
CID 9579635
N-benzyl-N-[(E)-furan-2-ylmethylideneamino]aniline
CID 9652867
1-(furan-2-yl)-N-(4-methoxyphenyl)methanimine oxide
CID 11183543
4-((1E)-2-(2-furyl)-1-azavinyl)phenol
CID 674723
Furfural phenylhydrazone
CID 6436740

Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-ylmethylideneamino)-N,N-dimethylaniline?
The IUPAC name of 4-(furan-2-ylmethylideneamino)-N,N-dimethylaniline (CID 781698) is 4-(furan-2-ylmethylideneamino)-N,N-dimethylaniline.
What is the SMILES notation for 4-(furan-2-ylmethylideneamino)-N,N-dimethylaniline?
The canonical SMILES for 4-(furan-2-ylmethylideneamino)-N,N-dimethylaniline is CN(C)c1ccc(/N=C/c2ccco2)cc1.
What is the InChIKey of 4-(furan-2-ylmethylideneamino)-N,N-dimethylaniline?
The InChIKey is JRYZHBZAMKMHEZ-GXDHUFHOSA-N. The full InChI is InChI=1S/C13H14N2O/c1-15(2)12-7-5-11(6-8-12)14-10-13-4-3-9-16-13/h3-10H,1-2H3/b14-10+.
What are the key properties of 4-(furan-2-ylmethylideneamino)-N,N-dimethylaniline?
4-(furan-2-ylmethylideneamino)-N,N-dimethylaniline has a molecular weight of 214.27 g/mol, XLogP of 3.10, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-ylmethylideneamino)-N,N-dimethylaniline is sourced from PubChem (CID 781698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).