N-(1,1-dimethoxypropan-2-yl)nonanamide

C14H29NO3 — CID 65448217

IUPACN-(1,1-dimethoxypropan-2-yl)nonanamide
SMILESCCCCCCCCC(=O)NC(C)C(OC)OC
InChIInChI=1S/C14H29NO3/c1-5-6-7-8-9-10-11-13(16)15-12(2)14(17-3)18-4/h12,14H,5-11H2,1-4H3,(H,15,16)
InChIKeyCBBIMADULYFKNJ-UHFFFAOYSA-N
MW259.39 g/mol
LogP2.86
Rot. Bonds11

About N-(1,1-dimethoxypropan-2-yl)nonanamide

N-(1,1-dimethoxypropan-2-yl)nonanamide (PubChem CID 65448217) has the molecular formula C14H29NO3 and a molecular weight of 259.39 g/mol. Its IUPAC name is N-(1,1-dimethoxypropan-2-yl)nonanamide.

Molecular Properties

Compound NameN-(1,1-dimethoxypropan-2-yl)nonanamide
PubChem CID65448217
Molecular FormulaC14H29NO3
Molecular Weight259.39 g/mol
Exact Mass259.21
IUPAC NameN-(1,1-dimethoxypropan-2-yl)nonanamide
SMILESCCCCCCCCC(=O)NC(C)C(OC)OC
InChIInChI=1S/C14H29NO3/c1-5-6-7-8-9-10-11-13(16)15-12(2)14(17-3)18-4/h12,14H,5-11H2,1-4H3,(H,15,16)
InChIKeyCBBIMADULYFKNJ-UHFFFAOYSA-N
XLogP2.86
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

N-(4-hydroxy-3-methylbutan-2-yl)decanamide
CID 115770870
N-[(2S,3R)-3-hydroxyoctadecan-2-yl]hexacosanamide
CID 73242205
N-pentan-2-ylundecanamide
CID 173258559
N-heptan-2-yldodecanamide
CID 3484810
N-butan-2-ylhexacosanamide
CID 163047877
N-butan-2-ylnonanamide
CID 4188803
N-octadecan-2-ylhexadecanamide
CID 87600664
N-pentan-3-yldocosanamide
CID 123339332
methyl (2S)-2-(7-oxododecanoylamino)propanoate
CID 54049046
N-[(2S)-3-oxododecan-2-yl]nonanamide
CID 160686948
(2S)-2-(heptanoylamino)propanoic acid
CID 59127847
N-(1-hydroxypropan-2-yl)heptanamide
CID 43418581

Frequently Asked Questions

What is the IUPAC name of N-(1,1-dimethoxypropan-2-yl)nonanamide?
The IUPAC name of N-(1,1-dimethoxypropan-2-yl)nonanamide (CID 65448217) is N-(1,1-dimethoxypropan-2-yl)nonanamide.
What is the SMILES notation for N-(1,1-dimethoxypropan-2-yl)nonanamide?
The canonical SMILES for N-(1,1-dimethoxypropan-2-yl)nonanamide is CCCCCCCCC(=O)NC(C)C(OC)OC.
What is the InChIKey of N-(1,1-dimethoxypropan-2-yl)nonanamide?
The InChIKey is CBBIMADULYFKNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO3/c1-5-6-7-8-9-10-11-13(16)15-12(2)14(17-3)18-4/h12,14H,5-11H2,1-4H3,(H,15,16).
What are the key properties of N-(1,1-dimethoxypropan-2-yl)nonanamide?
N-(1,1-dimethoxypropan-2-yl)nonanamide has a molecular weight of 259.39 g/mol, XLogP of 2.86, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,1-dimethoxypropan-2-yl)nonanamide is sourced from PubChem (CID 65448217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).