N-cyclobutyl-N-(3-hydroxypropyl)decanamide

C17H33NO2 — CID 102866665

IUPACN-cyclobutyl-N-(3-hydroxypropyl)decanamide
SMILESCCCCCCCCCC(=O)N(CCCO)C1CCC1
InChIInChI=1S/C17H33NO2/c1-2-3-4-5-6-7-8-13-17(20)18(14-10-15-19)16-11-9-12-16/h16,19H,2-15H2,1H3
InChIKeyIHCIXCQFXNFCMG-UHFFFAOYSA-N
MW283.46 g/mol
LogP3.89
Rot. Bonds12

About N-cyclobutyl-N-(3-hydroxypropyl)decanamide

N-cyclobutyl-N-(3-hydroxypropyl)decanamide (PubChem CID 102866665) has the molecular formula C17H33NO2 and a molecular weight of 283.46 g/mol. Its IUPAC name is N-cyclobutyl-N-(3-hydroxypropyl)decanamide.

Molecular Properties

Compound NameN-cyclobutyl-N-(3-hydroxypropyl)decanamide
PubChem CID102866665
Molecular FormulaC17H33NO2
Molecular Weight283.46 g/mol
Exact Mass283.25
IUPAC NameN-cyclobutyl-N-(3-hydroxypropyl)decanamide
SMILESCCCCCCCCCC(=O)N(CCCO)C1CCC1
InChIInChI=1S/C17H33NO2/c1-2-3-4-5-6-7-8-13-17(20)18(14-10-15-19)16-11-9-12-16/h16,19H,2-15H2,1H3
InChIKeyIHCIXCQFXNFCMG-UHFFFAOYSA-N
XLogP3.89
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 53.89
H-Bond Donors ≤ 51
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-cyclobutyl-N-(3-hydroxypropyl)decanamide?
The IUPAC name of N-cyclobutyl-N-(3-hydroxypropyl)decanamide (CID 102866665) is N-cyclobutyl-N-(3-hydroxypropyl)decanamide.
What is the SMILES notation for N-cyclobutyl-N-(3-hydroxypropyl)decanamide?
The canonical SMILES for N-cyclobutyl-N-(3-hydroxypropyl)decanamide is CCCCCCCCCC(=O)N(CCCO)C1CCC1.
What is the InChIKey of N-cyclobutyl-N-(3-hydroxypropyl)decanamide?
The InChIKey is IHCIXCQFXNFCMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33NO2/c1-2-3-4-5-6-7-8-13-17(20)18(14-10-15-19)16-11-9-12-16/h16,19H,2-15H2,1H3.
What are the key properties of N-cyclobutyl-N-(3-hydroxypropyl)decanamide?
N-cyclobutyl-N-(3-hydroxypropyl)decanamide has a molecular weight of 283.46 g/mol, XLogP of 3.89, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-N-(3-hydroxypropyl)decanamide is sourced from PubChem (CID 102866665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).