N-(2-methylpropyl)decanamide

C14H29NO — CID 3613503

IUPACN-(2-methylpropyl)decanamide
SMILESCCCCCCCCCC(=O)NCC(C)C
InChIInChI=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)
InChIKeyJIOJLCAPGHFHDI-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.90
Rot. Bonds10

About N-(2-methylpropyl)decanamide

N-(2-methylpropyl)decanamide (PubChem CID 3613503) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is N-(2-methylpropyl)decanamide.

Molecular Properties

Compound NameN-(2-methylpropyl)decanamide
PubChem CID3613503
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC NameN-(2-methylpropyl)decanamide
SMILESCCCCCCCCCC(=O)NCC(C)C
InChIInChI=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)
InChIKeyJIOJLCAPGHFHDI-UHFFFAOYSA-N
XLogP3.90
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)decanamide?
The IUPAC name of N-(2-methylpropyl)decanamide (CID 3613503) is N-(2-methylpropyl)decanamide.
What is the SMILES notation for N-(2-methylpropyl)decanamide?
The canonical SMILES for N-(2-methylpropyl)decanamide is CCCCCCCCCC(=O)NCC(C)C.
What is the InChIKey of N-(2-methylpropyl)decanamide?
The InChIKey is JIOJLCAPGHFHDI-UHFFFAOYSA-N. The full InChI is 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).
What are the key properties of N-(2-methylpropyl)decanamide?
N-(2-methylpropyl)decanamide has a molecular weight of 227.39 g/mol, XLogP of 3.90, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)decanamide is sourced from PubChem (CID 3613503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).