N-[(2-hydroxyphenyl)methylideneamino]-2-(4-methoxyphenoxy)pentanamide

C19H22N2O4 — CID 3378119

IUPACN-[(2-hydroxyphenyl)methylideneamino]-2-(4-methoxyphenoxy)pentanamide
SMILESCCCC(Oc1ccc(OC)cc1)C(=O)NN=Cc1ccccc1O
InChIInChI=1S/C19H22N2O4/c1-3-6-18(25-16-11-9-15(24-2)10-12-16)19(23)21-20-13-14-7-4-5-8-17(14)22/h4-5,7-13,18,22H,3,6H2,1-2H3,(H,21,23)
InChIKeyFRZATIBYLOETQV-UHFFFAOYSA-N
MW342.40 g/mol
LogP3.10
Rot. Bonds8

About N-[(2-hydroxyphenyl)methylideneamino]-2-(4-methoxyphenoxy)pentanamide

N-[(2-hydroxyphenyl)methylideneamino]-2-(4-methoxyphenoxy)pentanamide (PubChem CID 3378119) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is N-[(2-hydroxyphenyl)methylideneamino]-2-(4-methoxyphenoxy)pentanamide.

Molecular Properties

Compound NameN-[(2-hydroxyphenyl)methylideneamino]-2-(4-methoxyphenoxy)pentanamide
PubChem CID3378119
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC NameN-[(2-hydroxyphenyl)methylideneamino]-2-(4-methoxyphenoxy)pentanamide
SMILESCCCC(Oc1ccc(OC)cc1)C(=O)NN=Cc1ccccc1O
InChIInChI=1S/C19H22N2O4/c1-3-6-18(25-16-11-9-15(24-2)10-12-16)19(23)21-20-13-14-7-4-5-8-17(14)22/h4-5,7-13,18,22H,3,6H2,1-2H3,(H,21,23)
InChIKeyFRZATIBYLOETQV-UHFFFAOYSA-N
XLogP3.10
TPSA80.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2R)-N-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-phenoxybutanamide
CID 136728520
N-[(2-hydroxyphenyl)methylideneamino]-4-methoxybenzamide
CID 584655
N-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-(4-methoxyanilino)propanamide
CID 135782070
(2R)-N-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-(6-methoxynaphthalen-2-yl)propanamide
CID 136662783
4-butoxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide
CID 136762755
N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-naphthalen-2-yloxypropanamide
CID 135472410
2-hydroxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]-4-methoxybenzamide
CID 137156038
N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-(4-methoxyphenyl)sulfanylacetamide
CID 135716269
(2S)-N-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-(4-methoxy-N-methylsulfonylanilino)propanamide
CID 136900641
N-[3-[(2E)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-3-oxopropyl]-4-methoxybenzamide
CID 135715603
(2S)-2-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]propanamide
CID 135688184
N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-[(4-methoxybenzoyl)amino]benzamide
CID 135479229

Frequently Asked Questions

What is the IUPAC name of N-[(2-hydroxyphenyl)methylideneamino]-2-(4-methoxyphenoxy)pentanamide?
The IUPAC name of N-[(2-hydroxyphenyl)methylideneamino]-2-(4-methoxyphenoxy)pentanamide (CID 3378119) is N-[(2-hydroxyphenyl)methylideneamino]-2-(4-methoxyphenoxy)pentanamide.
What is the SMILES notation for N-[(2-hydroxyphenyl)methylideneamino]-2-(4-methoxyphenoxy)pentanamide?
The canonical SMILES for N-[(2-hydroxyphenyl)methylideneamino]-2-(4-methoxyphenoxy)pentanamide is CCCC(Oc1ccc(OC)cc1)C(=O)NN=Cc1ccccc1O.
What is the InChIKey of N-[(2-hydroxyphenyl)methylideneamino]-2-(4-methoxyphenoxy)pentanamide?
The InChIKey is FRZATIBYLOETQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-3-6-18(25-16-11-9-15(24-2)10-12-16)19(23)21-20-13-14-7-4-5-8-17(14)22/h4-5,7-13,18,22H,3,6H2,1-2H3,(H,21,23).
What are the key properties of N-[(2-hydroxyphenyl)methylideneamino]-2-(4-methoxyphenoxy)pentanamide?
N-[(2-hydroxyphenyl)methylideneamino]-2-(4-methoxyphenoxy)pentanamide has a molecular weight of 342.40 g/mol, XLogP of 3.10, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-hydroxyphenyl)methylideneamino]-2-(4-methoxyphenoxy)pentanamide is sourced from PubChem (CID 3378119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).