N,N-bis(2-hydroxyethyl)dodecanamide

C16H33NO3 — CID 8430

IUPACN,N-bis(2-hydroxyethyl)dodecanamide
SMILESCCCCCCCCCCCC(=O)N(CCO)CCO
InChIInChI=1S/C16H33NO3/c1-2-3-4-5-6-7-8-9-10-11-16(20)17(12-14-18)13-15-19/h18-19H,2-15H2,1H3
InChIKeyAOMUHOFOVNGZAN-UHFFFAOYSA-N
MW287.44 g/mol
LogP2.72
Rot. Bonds14

About N,N-bis(2-hydroxyethyl)dodecanamide

N,N-bis(2-hydroxyethyl)dodecanamide (PubChem CID 8430) has the molecular formula C16H33NO3 and a molecular weight of 287.44 g/mol. Its IUPAC name is N,N-bis(2-hydroxyethyl)dodecanamide.

Molecular Properties

Compound NameN,N-bis(2-hydroxyethyl)dodecanamide
PubChem CID8430
Molecular FormulaC16H33NO3
Molecular Weight287.44 g/mol
Exact Mass287.25
IUPAC NameN,N-bis(2-hydroxyethyl)dodecanamide
SMILESCCCCCCCCCCCC(=O)N(CCO)CCO
InChIInChI=1S/C16H33NO3/c1-2-3-4-5-6-7-8-9-10-11-16(20)17(12-14-18)13-15-19/h18-19H,2-15H2,1H3
InChIKeyAOMUHOFOVNGZAN-UHFFFAOYSA-N
XLogP2.72
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.44
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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,N-bis(2-hydroxyethyl)dodecanamide?
The IUPAC name of N,N-bis(2-hydroxyethyl)dodecanamide (CID 8430) is N,N-bis(2-hydroxyethyl)dodecanamide.
What is the SMILES notation for N,N-bis(2-hydroxyethyl)dodecanamide?
The canonical SMILES for N,N-bis(2-hydroxyethyl)dodecanamide is CCCCCCCCCCCC(=O)N(CCO)CCO.
What is the InChIKey of N,N-bis(2-hydroxyethyl)dodecanamide?
The InChIKey is AOMUHOFOVNGZAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33NO3/c1-2-3-4-5-6-7-8-9-10-11-16(20)17(12-14-18)13-15-19/h18-19H,2-15H2,1H3.
What are the key properties of N,N-bis(2-hydroxyethyl)dodecanamide?
N,N-bis(2-hydroxyethyl)dodecanamide has a molecular weight of 287.44 g/mol, XLogP of 2.72, 14 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2-hydroxyethyl)dodecanamide is sourced from PubChem (CID 8430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).