N,N'-bis(furan-2-ylmethylideneamino)decanediamide

C20H26N4O4 — CID 5226719

IUPACN,N'-bis(furan-2-ylmethylideneamino)decanediamide
SMILESO=C(CCCCCCCCC(=O)NN=Cc1ccco1)NN=Cc1ccco1
InChIInChI=1S/C20H26N4O4/c25-19(23-21-15-17-9-7-13-27-17)11-5-3-1-2-4-6-12-20(26)24-22-16-18-10-8-14-28-18/h7-10,13-16H,1-6,11-12H2,(H,23,25)(H,24,26)
InChIKeyJXQWBPVIVYZQDL-UHFFFAOYSA-N
MW386.45 g/mol
LogP3.59
Rot. Bonds13

About N,N'-bis(furan-2-ylmethylideneamino)decanediamide

N,N'-bis(furan-2-ylmethylideneamino)decanediamide (PubChem CID 5226719) has the molecular formula C20H26N4O4 and a molecular weight of 386.45 g/mol. Its IUPAC name is N,N'-bis(furan-2-ylmethylideneamino)decanediamide.

Molecular Properties

Compound NameN,N'-bis(furan-2-ylmethylideneamino)decanediamide
PubChem CID5226719
Molecular FormulaC20H26N4O4
Molecular Weight386.45 g/mol
Exact Mass386.20
IUPAC NameN,N'-bis(furan-2-ylmethylideneamino)decanediamide
SMILESO=C(CCCCCCCCC(=O)NN=Cc1ccco1)NN=Cc1ccco1
InChIInChI=1S/C20H26N4O4/c25-19(23-21-15-17-9-7-13-27-17)11-5-3-1-2-4-6-12-20(26)24-22-16-18-10-8-14-28-18/h7-10,13-16H,1-6,11-12H2,(H,23,25)(H,24,26)
InChIKeyJXQWBPVIVYZQDL-UHFFFAOYSA-N
XLogP3.59
TPSA109.20 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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

(E)-N-[(E)-furan-2-ylmethylideneamino]-N'-[(Z)-furan-2-ylmethylideneamino]hex-3-enediamide
CID 45050499
N-[2-[2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]dodecanamide
CID 5101537
N'-[(Z)-furan-2-ylmethylideneamino]-N-(4-methylphenyl)butanediamide
CID 6053974
[(E)-furan-2-ylmethylideneamino]carbamic acid
CID 23219991
2-anilino-N-(furan-2-ylmethylideneamino)acetamide
CID 3757182
2-(4-ethylphenyl)-N-(furan-2-ylmethylideneamino)acetamide
CID 165354335
N-[(Z)-furan-2-ylmethylideneamino]-3-(1H-indol-3-yl)propanamide
CID 6049004
N-(2,5-dimethylphenyl)-N'-(furan-2-ylmethylideneamino)butanediamide
CID 3289300
N-(2,3-dimethylphenyl)-N'-(furan-2-ylmethylideneamino)butanediamide
CID 4164018
2-(4-bromoanilino)-N-[(Z)-furan-2-ylmethylideneamino]acetamide
CID 5404211
2-(4-fluoroanilino)-N-[(Z)-furan-2-ylmethylideneamino]acetamide
CID 5404241
N-[(E)-furan-2-ylmethylideneamino]-3-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)propanamide
CID 6897558

Frequently Asked Questions

What is the IUPAC name of N,N'-bis(furan-2-ylmethylideneamino)decanediamide?
The IUPAC name of N,N'-bis(furan-2-ylmethylideneamino)decanediamide (CID 5226719) is N,N'-bis(furan-2-ylmethylideneamino)decanediamide.
What is the SMILES notation for N,N'-bis(furan-2-ylmethylideneamino)decanediamide?
The canonical SMILES for N,N'-bis(furan-2-ylmethylideneamino)decanediamide is O=C(CCCCCCCCC(=O)NN=Cc1ccco1)NN=Cc1ccco1.
What is the InChIKey of N,N'-bis(furan-2-ylmethylideneamino)decanediamide?
The InChIKey is JXQWBPVIVYZQDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O4/c25-19(23-21-15-17-9-7-13-27-17)11-5-3-1-2-4-6-12-20(26)24-22-16-18-10-8-14-28-18/h7-10,13-16H,1-6,11-12H2,(H,23,25)(H,24,26).
What are the key properties of N,N'-bis(furan-2-ylmethylideneamino)decanediamide?
N,N'-bis(furan-2-ylmethylideneamino)decanediamide has a molecular weight of 386.45 g/mol, XLogP of 3.59, 13 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(furan-2-ylmethylideneamino)decanediamide is sourced from PubChem (CID 5226719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).