N-[1-(2-hydroxyphenyl)propylideneamino]-5-methylfuran-2-carboxamide

C15H16N2O3 — CID 868759

IUPACN-[1-(2-hydroxyphenyl)propylideneamino]-5-methylfuran-2-carboxamide
SMILESCCC(=NNC(=O)c1ccc(C)o1)c1ccccc1O
InChIInChI=1S/C15H16N2O3/c1-3-12(11-6-4-5-7-13(11)18)16-17-15(19)14-9-8-10(2)20-14/h4-9,18H,3H2,1-2H3,(H,17,19)
InChIKeyHKCKEOHPWYVCHD-UHFFFAOYSA-N
MW272.30 g/mol
LogP2.84
Rot. Bonds4

About N-[1-(2-hydroxyphenyl)propylideneamino]-5-methylfuran-2-carboxamide

N-[1-(2-hydroxyphenyl)propylideneamino]-5-methylfuran-2-carboxamide (PubChem CID 868759) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is N-[1-(2-hydroxyphenyl)propylideneamino]-5-methylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[1-(2-hydroxyphenyl)propylideneamino]-5-methylfuran-2-carboxamide
PubChem CID868759
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC NameN-[1-(2-hydroxyphenyl)propylideneamino]-5-methylfuran-2-carboxamide
SMILESCCC(=NNC(=O)c1ccc(C)o1)c1ccccc1O
InChIInChI=1S/C15H16N2O3/c1-3-12(11-6-4-5-7-13(11)18)16-17-15(19)14-9-8-10(2)20-14/h4-9,18H,3H2,1-2H3,(H,17,19)
InChIKeyHKCKEOHPWYVCHD-UHFFFAOYSA-N
XLogP2.84
TPSA74.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

N-[(E)-1-(2-hydroxyphenyl)propylideneamino]-4-methylbenzamide
CID 135716964
2-methyl-N-[1-(5-methylfuran-2-yl)propylideneamino]furan-3-carboxamide
CID 842534
N,N'-bis[1-(2-hydroxyphenyl)propylideneamino]hexanediamide
CID 3340797
N-[(Z)-(2-hydroxyphenyl)methylideneamino]-5-methylfuran-2-carboxamide
CID 137122771
N-[1-(2-hydroxyphenyl)propylideneamino]pentanamide
CID 4060923
5-bromo-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]furan-2-carboxamide
CID 135685001
3-hydroxy-N-[(Z)-1-(5-methylfuran-2-yl)ethylideneamino]naphthalene-2-carboxamide
CID 5413691
N-[1-(4-chlorophenyl)propylideneamino]-2-hydroxybenzamide
CID 4608756
N-[(E)-1-(2-hydroxyphenyl)propylideneamino]dodecanamide
CID 135533779
4-ethyl-N-[(E)-1-(5-fluoro-2-hydroxyphenyl)propylideneamino]benzamide
CID 135673781
2-methoxy-N-[1-(5-methylfuran-2-yl)ethylideneamino]benzamide
CID 868019
2-methyl-N-[(Z)-1-phenylpropylideneamino]benzamide
CID 5391962

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-hydroxyphenyl)propylideneamino]-5-methylfuran-2-carboxamide?
The IUPAC name of N-[1-(2-hydroxyphenyl)propylideneamino]-5-methylfuran-2-carboxamide (CID 868759) is N-[1-(2-hydroxyphenyl)propylideneamino]-5-methylfuran-2-carboxamide.
What is the SMILES notation for N-[1-(2-hydroxyphenyl)propylideneamino]-5-methylfuran-2-carboxamide?
The canonical SMILES for N-[1-(2-hydroxyphenyl)propylideneamino]-5-methylfuran-2-carboxamide is CCC(=NNC(=O)c1ccc(C)o1)c1ccccc1O.
What is the InChIKey of N-[1-(2-hydroxyphenyl)propylideneamino]-5-methylfuran-2-carboxamide?
The InChIKey is HKCKEOHPWYVCHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c1-3-12(11-6-4-5-7-13(11)18)16-17-15(19)14-9-8-10(2)20-14/h4-9,18H,3H2,1-2H3,(H,17,19).
What are the key properties of N-[1-(2-hydroxyphenyl)propylideneamino]-5-methylfuran-2-carboxamide?
N-[1-(2-hydroxyphenyl)propylideneamino]-5-methylfuran-2-carboxamide has a molecular weight of 272.30 g/mol, XLogP of 2.84, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-hydroxyphenyl)propylideneamino]-5-methylfuran-2-carboxamide is sourced from PubChem (CID 868759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).