N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-2-methylpropanamide

C13H18N2O2 — CID 27877650

IUPACN-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-2-methylpropanamide
SMILESCOc1ccc(/C(C)=N\NC(=O)C(C)C)cc1
InChIInChI=1S/C13H18N2O2/c1-9(2)13(16)15-14-10(3)11-5-7-12(17-4)8-6-11/h5-9H,1-4H3,(H,15,16)/b14-10-
InChIKeyJMIDNSXNSFKNHC-UVTDQMKNSA-N
MW234.30 g/mol
LogP2.19
Rot. Bonds4

About N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-2-methylpropanamide

N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-2-methylpropanamide (PubChem CID 27877650) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-2-methylpropanamide.

Molecular Properties

Compound NameN-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-2-methylpropanamide
PubChem CID27877650
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC NameN-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-2-methylpropanamide
SMILESCOc1ccc(/C(C)=N\NC(=O)C(C)C)cc1
InChIInChI=1S/C13H18N2O2/c1-9(2)13(16)15-14-10(3)11-5-7-12(17-4)8-6-11/h5-9H,1-4H3,(H,15,16)/b14-10-
InChIKeyJMIDNSXNSFKNHC-UVTDQMKNSA-N
XLogP2.19
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 52.19
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,N'-bis[1-(4-methoxyphenyl)ethylideneamino]oxamide
CID 4100154
2-(4-chloroanilino)-N-[1-(4-methoxyphenyl)ethylideneamino]propanamide
CID 71960114
(2R)-2-(4-methoxyanilino)-N-[(E)-1-phenylethylideneamino]propanamide
CID 5403118
4-bromo-N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]benzamide
CID 6062256
N-[(E)-1-(4-methoxyphenyl)ethylideneamino]butanamide
CID 17340092
N,N'-bis[1-(4-methoxyphenyl)ethylideneamino]octanediamide
CID 3411990
N-[1-(4-ethylphenyl)ethylideneamino]-2-(4-methoxyphenyl)acetamide
CID 4247577
N-[(Z)-1-[4-(difluoromethoxy)phenyl]ethylideneamino]-4-methoxybenzamide
CID 9359355
N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-4-phenylbenzamide
CID 5496134
2-(4-methoxyanilino)-N-(1-naphthalen-2-ylethylideneamino)propanamide
CID 71960241
N-(4-methoxyphenyl)-N'-[1-(4-methylphenyl)ethylideneamino]oxamide
CID 3377445
N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]naphthalene-2-carboxamide
CID 124908769

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-2-methylpropanamide?
The IUPAC name of N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-2-methylpropanamide (CID 27877650) is N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-2-methylpropanamide.
What is the SMILES notation for N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-2-methylpropanamide?
The canonical SMILES for N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-2-methylpropanamide is COc1ccc(/C(C)=N\NC(=O)C(C)C)cc1.
What is the InChIKey of N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-2-methylpropanamide?
The InChIKey is JMIDNSXNSFKNHC-UVTDQMKNSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-9(2)13(16)15-14-10(3)11-5-7-12(17-4)8-6-11/h5-9H,1-4H3,(H,15,16)/b14-10-.
What are the key properties of N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-2-methylpropanamide?
N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-2-methylpropanamide has a molecular weight of 234.30 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-2-methylpropanamide is sourced from PubChem (CID 27877650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).