N-[(Z)-(2-ethoxyphenyl)methylideneamino]pentanamide

C14H20N2O2 — CID 5381098

IUPACN-[(Z)-(2-ethoxyphenyl)methylideneamino]pentanamide
SMILESCCCCC(=O)N/N=C\c1ccccc1OCC
InChIInChI=1S/C14H20N2O2/c1-3-5-10-14(17)16-15-11-12-8-6-7-9-13(12)18-4-2/h6-9,11H,3-5,10H2,1-2H3,(H,16,17)/b15-11-
InChIKeyQQNRGTHEPQYJIP-PTNGSMBKSA-N
MW248.33 g/mol
LogP2.73
Rot. Bonds7

About N-[(Z)-(2-ethoxyphenyl)methylideneamino]pentanamide

N-[(Z)-(2-ethoxyphenyl)methylideneamino]pentanamide (PubChem CID 5381098) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-[(Z)-(2-ethoxyphenyl)methylideneamino]pentanamide.

Molecular Properties

Compound NameN-[(Z)-(2-ethoxyphenyl)methylideneamino]pentanamide
PubChem CID5381098
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-[(Z)-(2-ethoxyphenyl)methylideneamino]pentanamide
SMILESCCCCC(=O)N/N=C\c1ccccc1OCC
InChIInChI=1S/C14H20N2O2/c1-3-5-10-14(17)16-15-11-12-8-6-7-9-13(12)18-4-2/h6-9,11H,3-5,10H2,1-2H3,(H,16,17)/b15-11-
InChIKeyQQNRGTHEPQYJIP-PTNGSMBKSA-N
XLogP2.73
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.73
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-[(3-ethoxy-2-hydroxyphenyl)methylideneamino]dodecanamide
CID 3536495
N-[(E)-(2-prop-2-enoxyphenyl)methylideneamino]tetradecanamide
CID 45054649
N-[(E)-(2-ethoxy-3-methoxyphenyl)methylideneamino]pentanamide
CID 110506839
N-[(E)-(2-phenylmethoxyphenyl)methylideneamino]hexadecanamide
CID 51060625
methyl N-[(Z)-(2-ethoxyphenyl)methylideneamino]carbamate
CID 5417453
N-[(E)-(2-hydroxyphenyl)methylideneamino]pentanamide
CID 135509646
N-(2,5-dimethylphenyl)-N'-[(2-ethoxyphenyl)methylideneamino]butanediamide
CID 3297111
4-(2-bromo-4-ethylphenoxy)-N-[(E)-(2-ethoxyphenyl)methylideneamino]butanamide
CID 19208224
N-[(E)-(2-ethoxyphenyl)methylideneamino]-2-methylpropanamide
CID 94833649
N,N'-bis[(2-prop-2-enoxyphenyl)methylideneamino]pentanediamide
CID 3634510
N-[(Z)-(2-ethoxyphenyl)methylideneamino]-2-naphthalen-1-ylacetamide
CID 5416826
N-[(2-ethoxyphenyl)methylideneamino]-2-(4-methoxyphenyl)acetamide
CID 968708

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(2-ethoxyphenyl)methylideneamino]pentanamide?
The IUPAC name of N-[(Z)-(2-ethoxyphenyl)methylideneamino]pentanamide (CID 5381098) is N-[(Z)-(2-ethoxyphenyl)methylideneamino]pentanamide.
What is the SMILES notation for N-[(Z)-(2-ethoxyphenyl)methylideneamino]pentanamide?
The canonical SMILES for N-[(Z)-(2-ethoxyphenyl)methylideneamino]pentanamide is CCCCC(=O)N/N=C\c1ccccc1OCC.
What is the InChIKey of N-[(Z)-(2-ethoxyphenyl)methylideneamino]pentanamide?
The InChIKey is QQNRGTHEPQYJIP-PTNGSMBKSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-3-5-10-14(17)16-15-11-12-8-6-7-9-13(12)18-4-2/h6-9,11H,3-5,10H2,1-2H3,(H,16,17)/b15-11-.
What are the key properties of N-[(Z)-(2-ethoxyphenyl)methylideneamino]pentanamide?
N-[(Z)-(2-ethoxyphenyl)methylideneamino]pentanamide has a molecular weight of 248.33 g/mol, XLogP of 2.73, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(2-ethoxyphenyl)methylideneamino]pentanamide is sourced from PubChem (CID 5381098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).