2-hydroxy-2-methyl-N-[3-(2-methylpropoxy)propyl]propanamide

C11H23NO3 — CID 104936506

IUPAC2-hydroxy-2-methyl-N-[3-(2-methylpropoxy)propyl]propanamide
SMILESCC(C)COCCCNC(=O)C(C)(C)O
InChIInChI=1S/C11H23NO3/c1-9(2)8-15-7-5-6-12-10(13)11(3,4)14/h9,14H,5-8H2,1-4H3,(H,12,13)
InChIKeyCPMABEHGOGHCCE-UHFFFAOYSA-N
MW217.31 g/mol
LogP0.94
Rot. Bonds7

About 2-hydroxy-2-methyl-N-[3-(2-methylpropoxy)propyl]propanamide

2-hydroxy-2-methyl-N-[3-(2-methylpropoxy)propyl]propanamide (PubChem CID 104936506) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is 2-hydroxy-2-methyl-N-[3-(2-methylpropoxy)propyl]propanamide.

Molecular Properties

Compound Name2-hydroxy-2-methyl-N-[3-(2-methylpropoxy)propyl]propanamide
PubChem CID104936506
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC Name2-hydroxy-2-methyl-N-[3-(2-methylpropoxy)propyl]propanamide
SMILESCC(C)COCCCNC(=O)C(C)(C)O
InChIInChI=1S/C11H23NO3/c1-9(2)8-15-7-5-6-12-10(13)11(3,4)14/h9,14H,5-8H2,1-4H3,(H,12,13)
InChIKeyCPMABEHGOGHCCE-UHFFFAOYSA-N
XLogP0.94
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-N-[3-(2-methylpropoxy)propyl]propanamide
CID 60714986
2-hydroxy-2-methyl-N-(4-methylpentyl)propanamide
CID 104936584
N-[3-(2-methylpropoxy)propyl]propanamide
CID 60705995
2-hydroxy-2-methyl-N-(5-methylhexyl)propanamide
CID 103430276
3-methyl-3-[3-(2-methylpropoxy)propylcarbamoylamino]butanoic acid
CID 114098397
(2S)-3,3-dimethyl-2-[3-(2-methylpropoxy)propylcarbamoylamino]butanoic acid
CID 103994527
2-hydroxy-2-methyl-N-(3-methylbutyl)propanamide
CID 104936395
2-(methylamino)-N-[3-(2-methylpropoxy)propyl]acetamide;hydrochloride
CID 119693610
(2S,3S)-2-amino-3-methyl-N-[3-(2-methylpropoxy)propyl]pentanamide
CID 61155526
N-methyl-N'-[3-(2-methylpropoxy)propyl]pentanediamide
CID 167464495
N'-(cyanomethyl)-N-[3-(2-methylpropoxy)propyl]oxamide
CID 114097982
2-amino-2-cyclopropyl-N-[2-(2-methylpropoxy)ethyl]propanamide
CID 115746731

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-methyl-N-[3-(2-methylpropoxy)propyl]propanamide?
The IUPAC name of 2-hydroxy-2-methyl-N-[3-(2-methylpropoxy)propyl]propanamide (CID 104936506) is 2-hydroxy-2-methyl-N-[3-(2-methylpropoxy)propyl]propanamide.
What is the SMILES notation for 2-hydroxy-2-methyl-N-[3-(2-methylpropoxy)propyl]propanamide?
The canonical SMILES for 2-hydroxy-2-methyl-N-[3-(2-methylpropoxy)propyl]propanamide is CC(C)COCCCNC(=O)C(C)(C)O.
What is the InChIKey of 2-hydroxy-2-methyl-N-[3-(2-methylpropoxy)propyl]propanamide?
The InChIKey is CPMABEHGOGHCCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3/c1-9(2)8-15-7-5-6-12-10(13)11(3,4)14/h9,14H,5-8H2,1-4H3,(H,12,13).
What are the key properties of 2-hydroxy-2-methyl-N-[3-(2-methylpropoxy)propyl]propanamide?
2-hydroxy-2-methyl-N-[3-(2-methylpropoxy)propyl]propanamide has a molecular weight of 217.31 g/mol, XLogP of 0.94, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-methyl-N-[3-(2-methylpropoxy)propyl]propanamide is sourced from PubChem (CID 104936506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).