N-(1-hydroxy-2-methylpropan-2-yl)dodecanamide

C16H33NO2 — CID 13410459

IUPACN-(1-hydroxy-2-methylpropan-2-yl)dodecanamide
SMILESCCCCCCCCCCCC(=O)NC(C)(C)CO
InChIInChI=1S/C16H33NO2/c1-4-5-6-7-8-9-10-11-12-13-15(19)17-16(2,3)14-18/h18H,4-14H2,1-3H3,(H,17,19)
InChIKeyQROTZONZJHQNEM-UHFFFAOYSA-N
MW271.44 g/mol
LogP3.79
Rot. Bonds12

About N-(1-hydroxy-2-methylpropan-2-yl)dodecanamide

N-(1-hydroxy-2-methylpropan-2-yl)dodecanamide (PubChem CID 13410459) has the molecular formula C16H33NO2 and a molecular weight of 271.44 g/mol. Its IUPAC name is N-(1-hydroxy-2-methylpropan-2-yl)dodecanamide.

Molecular Properties

Compound NameN-(1-hydroxy-2-methylpropan-2-yl)dodecanamide
PubChem CID13410459
Molecular FormulaC16H33NO2
Molecular Weight271.44 g/mol
Exact Mass271.25
IUPAC NameN-(1-hydroxy-2-methylpropan-2-yl)dodecanamide
SMILESCCCCCCCCCCCC(=O)NC(C)(C)CO
InChIInChI=1S/C16H33NO2/c1-4-5-6-7-8-9-10-11-12-13-15(19)17-16(2,3)14-18/h18H,4-14H2,1-3H3,(H,17,19)
InChIKeyQROTZONZJHQNEM-UHFFFAOYSA-N
XLogP3.79
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.44
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

7-amino-N-(1-hydroxy-2-methylpropan-2-yl)heptanamide
CID 43500036
N-(2-hydroxypropan-2-yl)heptanamide
CID 139307065
carbanide;N-(2-methylbutan-2-yl)hexadecanamide;osmium(2+)
CID 162756448
N-[3-(hydroxymethyl)pentan-3-yl]dodecanamide
CID 65427888
N-(1-hydroxy-2-methylpropan-2-yl)-5-oxoheptanamide
CID 171807744
N-[3-(hydroxymethyl)pentan-3-yl]octanamide
CID 55082633
N-(3-methylpentan-3-yl)hexanamide
CID 90883485
N-(2-methylbut-3-yn-2-yl)dodecanamide
CID 65426604
3-chloro-N-(1-hydroxy-2-methylpropan-2-yl)propanamide
CID 61251175
[6-[(1,3-dihydroxy-2-methylpropan-2-yl)amino]-6-oxohexyl] octadecanoate
CID 90164708
N-(1-bromo-2-methylbutan-2-yl)nonanamide
CID 114314390
N-[2-(ethylamino)butan-2-yl]icosanamide
CID 158301838

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-2-methylpropan-2-yl)dodecanamide?
The IUPAC name of N-(1-hydroxy-2-methylpropan-2-yl)dodecanamide (CID 13410459) is N-(1-hydroxy-2-methylpropan-2-yl)dodecanamide.
What is the SMILES notation for N-(1-hydroxy-2-methylpropan-2-yl)dodecanamide?
The canonical SMILES for N-(1-hydroxy-2-methylpropan-2-yl)dodecanamide is CCCCCCCCCCCC(=O)NC(C)(C)CO.
What is the InChIKey of N-(1-hydroxy-2-methylpropan-2-yl)dodecanamide?
The InChIKey is QROTZONZJHQNEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33NO2/c1-4-5-6-7-8-9-10-11-12-13-15(19)17-16(2,3)14-18/h18H,4-14H2,1-3H3,(H,17,19).
What are the key properties of N-(1-hydroxy-2-methylpropan-2-yl)dodecanamide?
N-(1-hydroxy-2-methylpropan-2-yl)dodecanamide has a molecular weight of 271.44 g/mol, XLogP of 3.79, 12 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-2-methylpropan-2-yl)dodecanamide is sourced from PubChem (CID 13410459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).