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

C13H14N2O — CID 9014700

IUPACN-[(Z)-1-(furan-2-yl)ethylideneamino]-2-methylaniline
SMILESC/C(=N/Nc1ccccc1C)c1ccco1
InChIInChI=1S/C13H14N2O/c1-10-6-3-4-7-12(10)15-14-11(2)13-8-5-9-16-13/h3-9,15H,1-2H3/b14-11-
InChIKeyWTRQAOBOHCZBFN-KAMYIIQDSA-N
MW214.27 g/mol
LogP3.42
Rot. Bonds3

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

N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-methylaniline (PubChem CID 9014700) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-methylaniline.

Molecular Properties

Compound NameN-[(Z)-1-(furan-2-yl)ethylideneamino]-2-methylaniline
PubChem CID9014700
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC NameN-[(Z)-1-(furan-2-yl)ethylideneamino]-2-methylaniline
SMILESC/C(=N/Nc1ccccc1C)c1ccco1
InChIInChI=1S/C13H14N2O/c1-10-6-3-4-7-12(10)15-14-11(2)13-8-5-9-16-13/h3-9,15H,1-2H3/b14-11-
InChIKeyWTRQAOBOHCZBFN-KAMYIIQDSA-N
XLogP3.42
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 53.42
H-Bond Donors ≤ 51
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

N-[(E)-1-(furan-2-yl)ethylideneamino]furan-2-carboxamide
CID 5339845
N-[(E)-1-(furan-2-yl)ethylideneamino]-5-methyl-4-phenyl-1,3-thiazol-2-amine
CID 90666204
[(Z)-1-(furan-2-yl)ethylideneamino]urea
CID 5354823
N-[(E)-1-(furan-2-yl)ethylideneamino]-2-phenylacetamide
CID 5335640
N-[(E)-1-(furan-2-yl)ethylideneamino]benzamide
CID 5396908
N-[(Z)-1-(furan-2-yl)ethylideneamino]phthalazin-1-amine
CID 6418050
3-[(2E)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]benzoic acid
CID 16555832
N-[(Z)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylideneamino]-2-methylaniline
CID 9014748
5-[(Z)-C-methyl-N-(2-methylanilino)carbonimidoyl]thiophene-2-carboxylic acid
CID 8825867
tert-butyl N-[1-(furan-2-yl)ethylideneamino]carbamate
CID 3874602
3,5-dichloro-N-[1-(furan-2-yl)ethylideneamino]pyridin-2-amine
CID 4833509
N-[(Z)-1-(furan-2-yl)ethylideneamino]-3-phenylpropanamide
CID 6339329

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-methylaniline?
The IUPAC name of N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-methylaniline (CID 9014700) is N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-methylaniline.
What is the SMILES notation for N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-methylaniline?
The canonical SMILES for N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-methylaniline is C/C(=N/Nc1ccccc1C)c1ccco1.
What is the InChIKey of N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-methylaniline?
The InChIKey is WTRQAOBOHCZBFN-KAMYIIQDSA-N. The full InChI is InChI=1S/C13H14N2O/c1-10-6-3-4-7-12(10)15-14-11(2)13-8-5-9-16-13/h3-9,15H,1-2H3/b14-11-.
What are the key properties of N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-methylaniline?
N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-methylaniline has a molecular weight of 214.27 g/mol, XLogP of 3.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-1-(furan-2-yl)ethylideneamino]-2-methylaniline is sourced from PubChem (CID 9014700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).