N-[(5-methylfuran-2-yl)methylideneamino]decanamide

C16H26N2O2 — CID 4150457

IUPACN-[(5-methylfuran-2-yl)methylideneamino]decanamide
SMILESCCCCCCCCCC(=O)NN=Cc1ccc(C)o1
InChIInChI=1S/C16H26N2O2/c1-3-4-5-6-7-8-9-10-16(19)18-17-13-15-12-11-14(2)20-15/h11-13H,3-10H2,1-2H3,(H,18,19)
InChIKeyVDXQJBYCRJTAFY-UHFFFAOYSA-N
MW278.40 g/mol
LogP4.18
Rot. Bonds10

About N-[(5-methylfuran-2-yl)methylideneamino]decanamide

N-[(5-methylfuran-2-yl)methylideneamino]decanamide (PubChem CID 4150457) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-[(5-methylfuran-2-yl)methylideneamino]decanamide.

Molecular Properties

Compound NameN-[(5-methylfuran-2-yl)methylideneamino]decanamide
PubChem CID4150457
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC NameN-[(5-methylfuran-2-yl)methylideneamino]decanamide
SMILESCCCCCCCCCC(=O)NN=Cc1ccc(C)o1
InChIInChI=1S/C16H26N2O2/c1-3-4-5-6-7-8-9-10-16(19)18-17-13-15-12-11-14(2)20-15/h11-13H,3-10H2,1-2H3,(H,18,19)
InChIKeyVDXQJBYCRJTAFY-UHFFFAOYSA-N
XLogP4.18
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

N-[2-[2-[(5-methylfuran-2-yl)methylidene]hydrazinyl]-2-oxoethyl]dodecanamide
CID 5202997
N-[(E)-(5-methylfuran-2-yl)methylideneamino]-4-phenylbutanamide
CID 171979033
N-[(E)-(4-methylphenyl)methylideneamino]octanamide
CID 6042307
1,3-bis[(E)-(5-methylfuran-2-yl)methylideneamino]urea
CID 177430726
N-[(E)-benzylideneamino]heptanamide
CID 6083821
N-(benzylideneamino)decanamide
CID 3430585
N,N'-bis[(5-bromofuran-2-yl)methylideneamino]octanediamide
CID 3286052
N-[(4-methoxyphenyl)methylideneamino]nonanamide
CID 4175341
N-[(4-butoxyphenyl)methylideneamino]dodecanamide
CID 3705573
N-[(4-ethylphenyl)methylideneamino]heptanamide
CID 4107938
N-[(E)-pyridin-4-ylmethylideneamino]hexadecanamide
CID 45055038
2-(4-chlorophenyl)-N-[(Z)-(5-methylfuran-2-yl)methylideneamino]acetamide
CID 5413519

Frequently Asked Questions

What is the IUPAC name of N-[(5-methylfuran-2-yl)methylideneamino]decanamide?
The IUPAC name of N-[(5-methylfuran-2-yl)methylideneamino]decanamide (CID 4150457) is N-[(5-methylfuran-2-yl)methylideneamino]decanamide.
What is the SMILES notation for N-[(5-methylfuran-2-yl)methylideneamino]decanamide?
The canonical SMILES for N-[(5-methylfuran-2-yl)methylideneamino]decanamide is CCCCCCCCCC(=O)NN=Cc1ccc(C)o1.
What is the InChIKey of N-[(5-methylfuran-2-yl)methylideneamino]decanamide?
The InChIKey is VDXQJBYCRJTAFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-3-4-5-6-7-8-9-10-16(19)18-17-13-15-12-11-14(2)20-15/h11-13H,3-10H2,1-2H3,(H,18,19).
What are the key properties of N-[(5-methylfuran-2-yl)methylideneamino]decanamide?
N-[(5-methylfuran-2-yl)methylideneamino]decanamide has a molecular weight of 278.40 g/mol, XLogP of 4.18, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methylfuran-2-yl)methylideneamino]decanamide is sourced from PubChem (CID 4150457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).