N-(10-hydroxy-10-methylundecyl)acetamide

C14H29NO2 — CID 38360593

IUPACN-(10-hydroxy-10-methylundecyl)acetamide
SMILESCC(=O)NCCCCCCCCCC(C)(C)O
InChIInChI=1S/C14H29NO2/c1-13(16)15-12-10-8-6-4-5-7-9-11-14(2,3)17/h17H,4-12H2,1-3H3,(H,15,16)
InChIKeyYASDXQQLKVMDLE-UHFFFAOYSA-N
MW243.39 g/mol
LogP3.01
Rot. Bonds10

About N-(10-hydroxy-10-methylundecyl)acetamide

N-(10-hydroxy-10-methylundecyl)acetamide (PubChem CID 38360593) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is N-(10-hydroxy-10-methylundecyl)acetamide.

Molecular Properties

Compound NameN-(10-hydroxy-10-methylundecyl)acetamide
PubChem CID38360593
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC NameN-(10-hydroxy-10-methylundecyl)acetamide
SMILESCC(=O)NCCCCCCCCCC(C)(C)O
InChIInChI=1S/C14H29NO2/c1-13(16)15-12-10-8-6-4-5-7-9-11-14(2,3)17/h17H,4-12H2,1-3H3,(H,15,16)
InChIKeyYASDXQQLKVMDLE-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-(10-hydroxy-10-methylundecyl)acetamide?
The IUPAC name of N-(10-hydroxy-10-methylundecyl)acetamide (CID 38360593) is N-(10-hydroxy-10-methylundecyl)acetamide.
What is the SMILES notation for N-(10-hydroxy-10-methylundecyl)acetamide?
The canonical SMILES for N-(10-hydroxy-10-methylundecyl)acetamide is CC(=O)NCCCCCCCCCC(C)(C)O.
What is the InChIKey of N-(10-hydroxy-10-methylundecyl)acetamide?
The InChIKey is YASDXQQLKVMDLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO2/c1-13(16)15-12-10-8-6-4-5-7-9-11-14(2,3)17/h17H,4-12H2,1-3H3,(H,15,16).
What are the key properties of N-(10-hydroxy-10-methylundecyl)acetamide?
N-(10-hydroxy-10-methylundecyl)acetamide 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-(10-hydroxy-10-methylundecyl)acetamide is sourced from PubChem (CID 38360593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).