2,2-diethyl-N-hydroxypentadecanamide

C19H39NO2 — CID 138558527

IUPAC2,2-diethyl-N-hydroxypentadecanamide
SMILESCCCCCCCCCCCCCC(CC)(CC)C(=O)NO
InChIInChI=1S/C19H39NO2/c1-4-7-8-9-10-11-12-13-14-15-16-17-19(5-2,6-3)18(21)20-22/h22H,4-17H2,1-3H3,(H,20,21)
InChIKeyQZSBUOUBSPUAQM-UHFFFAOYSA-N
MW313.53 g/mol
LogP6.00
Rot. Bonds15

About 2,2-diethyl-N-hydroxypentadecanamide

2,2-diethyl-N-hydroxypentadecanamide (PubChem CID 138558527) has the molecular formula C19H39NO2 and a molecular weight of 313.53 g/mol. Its IUPAC name is 2,2-diethyl-N-hydroxypentadecanamide.

Molecular Properties

Compound Name2,2-diethyl-N-hydroxypentadecanamide
PubChem CID138558527
Molecular FormulaC19H39NO2
Molecular Weight313.53 g/mol
Exact Mass313.30
IUPAC Name2,2-diethyl-N-hydroxypentadecanamide
SMILESCCCCCCCCCCCCCC(CC)(CC)C(=O)NO
InChIInChI=1S/C19H39NO2/c1-4-7-8-9-10-11-12-13-14-15-16-17-19(5-2,6-3)18(21)20-22/h22H,4-17H2,1-3H3,(H,20,21)
InChIKeyQZSBUOUBSPUAQM-UHFFFAOYSA-N
XLogP6.00
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds15
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500313.53
LogP ≤ 56.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2,2-diethyl-N-methylhexadecanamide
CID 158971138
2-ethyl-N-hydroxy-2-methylpentadecanamide
CID 138558679
N-hydroxy-2,2-dimethylheptadecanamide
CID 138558717
2-hexyl-N-hydroxy-2-methyloctanamide
CID 170033401
2,2-diethyltridecanoic acid
CID 138578067
2,2-diethylnonadecanoic acid
CID 139750929
N-(2-aminoethyl)-2,2-diethyloctanamide;hydrofluoride
CID 175966813
2-butyl-2-ethylnonanoic acid
CID 57042574
2-ethyl-2-pentylheptanamide
CID 87709137
2,9-dihexyl-2,9-dioctyldecanedioic acid
CID 172763339
2-dodecyl-2-octyltetradecanoic acid
CID 24889792
2,2-dihexyldecanoic acid
CID 57072933

Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-N-hydroxypentadecanamide?
The IUPAC name of 2,2-diethyl-N-hydroxypentadecanamide (CID 138558527) is 2,2-diethyl-N-hydroxypentadecanamide.
What is the SMILES notation for 2,2-diethyl-N-hydroxypentadecanamide?
The canonical SMILES for 2,2-diethyl-N-hydroxypentadecanamide is CCCCCCCCCCCCCC(CC)(CC)C(=O)NO.
What is the InChIKey of 2,2-diethyl-N-hydroxypentadecanamide?
The InChIKey is QZSBUOUBSPUAQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H39NO2/c1-4-7-8-9-10-11-12-13-14-15-16-17-19(5-2,6-3)18(21)20-22/h22H,4-17H2,1-3H3,(H,20,21).
What are the key properties of 2,2-diethyl-N-hydroxypentadecanamide?
2,2-diethyl-N-hydroxypentadecanamide has a molecular weight of 313.53 g/mol, XLogP of 6.00, 15 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-N-hydroxypentadecanamide is sourced from PubChem (CID 138558527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).