2-hexyl-N-hydroxyoctanamide

C14H29NO2 — CID 139661264

IUPAC2-hexyl-N-hydroxyoctanamide
SMILESCCCCCCC(CCCCCC)C(=O)NO
InChIInChI=1S/C14H29NO2/c1-3-5-7-9-11-13(14(16)15-17)12-10-8-6-4-2/h13,17H,3-12H2,1-2H3,(H,15,16)
InChIKeyGLBZWJZSHNQBRR-UHFFFAOYSA-N
MW243.39 g/mol
LogP4.05
Rot. Bonds11

About 2-hexyl-N-hydroxyoctanamide

2-hexyl-N-hydroxyoctanamide (PubChem CID 139661264) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is 2-hexyl-N-hydroxyoctanamide.

Molecular Properties

Compound Name2-hexyl-N-hydroxyoctanamide
PubChem CID139661264
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC Name2-hexyl-N-hydroxyoctanamide
SMILESCCCCCCC(CCCCCC)C(=O)NO
InChIInChI=1S/C14H29NO2/c1-3-5-7-9-11-13(14(16)15-17)12-10-8-6-4-2/h13,17H,3-12H2,1-2H3,(H,15,16)
InChIKeyGLBZWJZSHNQBRR-UHFFFAOYSA-N
XLogP4.05
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 54.05
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

N-octadecyl-2-octylicosanamide
CID 154636535
3-pentylnonan-2-one
CID 21290467
2-dodecyl-N-(2-dodecyltetradecanoylamino)oxytetradecanamide
CID 173246682
N-hydroxy-2-[[1-(hydroxyamino)-1-oxononan-2-yl]disulfanyl]nonanamide
CID 88515625
3-butylundecan-2-one
CID 10922232
N-hydroxy-2-pentyl-N'-phenyloctanediamide
CID 134143927
22,24-di(henicosyl)pentatetracontan-23-one
CID 174350862
9,11-dipentylnonadecan-10-one
CID 174915946
11,13-diheptyltricosan-12-one
CID 175328104
2-ethyl-N-methyltetradecanamide
CID 161072731
2-butyl-N-(3-methylbutyl)octanamide
CID 167250980
2-hexylpentacosanoic acid
CID 158257677

Frequently Asked Questions

What is the IUPAC name of 2-hexyl-N-hydroxyoctanamide?
The IUPAC name of 2-hexyl-N-hydroxyoctanamide (CID 139661264) is 2-hexyl-N-hydroxyoctanamide.
What is the SMILES notation for 2-hexyl-N-hydroxyoctanamide?
The canonical SMILES for 2-hexyl-N-hydroxyoctanamide is CCCCCCC(CCCCCC)C(=O)NO.
What is the InChIKey of 2-hexyl-N-hydroxyoctanamide?
The InChIKey is GLBZWJZSHNQBRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO2/c1-3-5-7-9-11-13(14(16)15-17)12-10-8-6-4-2/h13,17H,3-12H2,1-2H3,(H,15,16).
What are the key properties of 2-hexyl-N-hydroxyoctanamide?
2-hexyl-N-hydroxyoctanamide has a molecular weight of 243.39 g/mol, XLogP of 4.05, 11 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hexyl-N-hydroxyoctanamide is sourced from PubChem (CID 139661264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).