2-ethyl-N-hydroxy-2-methylpentadecanamide

C18H37NO2 — CID 138558679

IUPAC2-ethyl-N-hydroxy-2-methylpentadecanamide
SMILESCCCCCCCCCCCCCC(C)(CC)C(=O)NO
InChIInChI=1S/C18H37NO2/c1-4-6-7-8-9-10-11-12-13-14-15-16-18(3,5-2)17(20)19-21/h21H,4-16H2,1-3H3,(H,19,20)
InChIKeyRXZMHYMFOOXRKI-UHFFFAOYSA-N
MW299.50 g/mol
LogP5.61
Rot. Bonds14

About 2-ethyl-N-hydroxy-2-methylpentadecanamide

2-ethyl-N-hydroxy-2-methylpentadecanamide (PubChem CID 138558679) has the molecular formula C18H37NO2 and a molecular weight of 299.50 g/mol. Its IUPAC name is 2-ethyl-N-hydroxy-2-methylpentadecanamide.

Molecular Properties

Compound Name2-ethyl-N-hydroxy-2-methylpentadecanamide
PubChem CID138558679
Molecular FormulaC18H37NO2
Molecular Weight299.50 g/mol
Exact Mass299.28
IUPAC Name2-ethyl-N-hydroxy-2-methylpentadecanamide
SMILESCCCCCCCCCCCCCC(C)(CC)C(=O)NO
InChIInChI=1S/C18H37NO2/c1-4-6-7-8-9-10-11-12-13-14-15-16-18(3,5-2)17(20)19-21/h21H,4-16H2,1-3H3,(H,19,20)
InChIKeyRXZMHYMFOOXRKI-UHFFFAOYSA-N
XLogP5.61
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500299.50
LogP ≤ 55.61
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-hexyl-N-hydroxy-2-methyloctanamide
CID 170033401
N-hydroxy-2,2-dimethylheptadecanamide
CID 138558717
2,2-diethyl-N-hydroxypentadecanamide
CID 138558527
(3S)-3-ethyl-3-methylnonan-2-one
CID 177059310
11,15-didecyl-11,15-dimethylpentacosane-12,14-dione
CID 151089135
N-tert-butyl-2-ethyl-2-methylhexanamide
CID 146411812
2-ethyl-N-(3-methoxypropyl)-2-methyloctanamide
CID 134590765
2-[(2-ethyl-2-methyloctanoyl)amino]-2-methylpropane-1-sulfonic acid
CID 134415224
methyl 3-[(2-ethyl-2-methyloctanoyl)amino]propanoate
CID 135208354
2-decyl-2-methyltetradecanoic acid
CID 611890
2-decyl-2-methylicosanoic acid
CID 174997379
2-hexyl-2-methyldecanoic acid
CID 86051716

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-hydroxy-2-methylpentadecanamide?
The IUPAC name of 2-ethyl-N-hydroxy-2-methylpentadecanamide (CID 138558679) is 2-ethyl-N-hydroxy-2-methylpentadecanamide.
What is the SMILES notation for 2-ethyl-N-hydroxy-2-methylpentadecanamide?
The canonical SMILES for 2-ethyl-N-hydroxy-2-methylpentadecanamide is CCCCCCCCCCCCCC(C)(CC)C(=O)NO.
What is the InChIKey of 2-ethyl-N-hydroxy-2-methylpentadecanamide?
The InChIKey is RXZMHYMFOOXRKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37NO2/c1-4-6-7-8-9-10-11-12-13-14-15-16-18(3,5-2)17(20)19-21/h21H,4-16H2,1-3H3,(H,19,20).
What are the key properties of 2-ethyl-N-hydroxy-2-methylpentadecanamide?
2-ethyl-N-hydroxy-2-methylpentadecanamide has a molecular weight of 299.50 g/mol, XLogP of 5.61, 14 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-hydroxy-2-methylpentadecanamide is sourced from PubChem (CID 138558679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).