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N-Isobutyl decanamide

CAT: 0931-T33681-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T33681-01Size:1 mg
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CAS Number
73785-31-6
Target
Others, NO Synthase
Related Pathways
Others, Immunology/Inflammation
Purity
0.972
Bioactivity
N-Isobutyl decanamide (N-Isobutyl N-decanamide) is an amphiphilic derivative belonging to the class of alkanamides with potential anti-inflammatory activity that promotes growth and alters root development in Arabidopsis.
Smiles
O=C(NCC(C)C)CCCCCCCCC
Molecular Formula
C14H29NO
Molecular Weight
227.39
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-isobutyl-decanamide

N-isobutyl decanamide has been reported in Piper swartzianum and Piper tuberculatum with data available.

CAS Number73785-31-6
PubChem CID3613503
IUPAC NameN-(2-methylpropyl)decanamide
Molecular FormulaC14H29NO
Molecular Weight227.39
XLogP4.9
Topological Polar Surface Area29.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count10
Heavy Atom Count16
Formal Charge0
Complexity166
SMILES
CCCCCCCCCC(=O)NCC(C)C
InChI
InChI=1S/C14H29NO/c1-4-5-6-7-8-9-10-11-14(16)15-12-13(2)3/h13H,4-12H2,1-3H3,(H,15,16)
InChIKey
JIOJLCAPGHFHDI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-isobutyl-decanamide
CAS: 73785-31-6
CID: 3613503
Formula: C14H29NO
MW: 227.39
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight227.39
XLogP34.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count10
Exact Mass227.224914549
Monoisotopic Mass227.224914549
Topological Polar Surface Area29.1 Ų
Heavy Atom Count16
Formal Charge0
Complexity166
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes