N-(1-hydroxy-2-methylpropan-2-yl)decanamide

C14H29NO2 — CID 3015818

IUPACN-(1-hydroxy-2-methylpropan-2-yl)decanamide
SMILESCCCCCCCCCC(=O)NC(C)(C)CO
InChIInChI=1S/C14H29NO2/c1-4-5-6-7-8-9-10-11-13(17)15-14(2,3)12-16/h16H,4-12H2,1-3H3,(H,15,17)
InChIKeyIWZPIXUPMVBLSB-UHFFFAOYSA-N
MW243.39 g/mol
LogP3.01
Rot. Bonds10

About N-(1-hydroxy-2-methylpropan-2-yl)decanamide

N-(1-hydroxy-2-methylpropan-2-yl)decanamide (PubChem CID 3015818) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is N-(1-hydroxy-2-methylpropan-2-yl)decanamide.

Molecular Properties

Compound NameN-(1-hydroxy-2-methylpropan-2-yl)decanamide
PubChem CID3015818
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC NameN-(1-hydroxy-2-methylpropan-2-yl)decanamide
SMILESCCCCCCCCCC(=O)NC(C)(C)CO
InChIInChI=1S/C14H29NO2/c1-4-5-6-7-8-9-10-11-13(17)15-14(2,3)12-16/h16H,4-12H2,1-3H3,(H,15,17)
InChIKeyIWZPIXUPMVBLSB-UHFFFAOYSA-N
XLogP3.01
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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-(1-hydroxy-2-methylpropan-2-yl)decanamide?
The IUPAC name of N-(1-hydroxy-2-methylpropan-2-yl)decanamide (CID 3015818) is N-(1-hydroxy-2-methylpropan-2-yl)decanamide.
What is the SMILES notation for N-(1-hydroxy-2-methylpropan-2-yl)decanamide?
The canonical SMILES for N-(1-hydroxy-2-methylpropan-2-yl)decanamide is CCCCCCCCCC(=O)NC(C)(C)CO.
What is the InChIKey of N-(1-hydroxy-2-methylpropan-2-yl)decanamide?
The InChIKey is IWZPIXUPMVBLSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO2/c1-4-5-6-7-8-9-10-11-13(17)15-14(2,3)12-16/h16H,4-12H2,1-3H3,(H,15,17).
What are the key properties of N-(1-hydroxy-2-methylpropan-2-yl)decanamide?
N-(1-hydroxy-2-methylpropan-2-yl)decanamide has a molecular weight of 243.39 g/mol, XLogP of 3.01, 10 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-2-methylpropan-2-yl)decanamide is sourced from PubChem (CID 3015818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).