N-(1-methoxybutyl)-N-(methoxymethyl)-2-methylpropanamide

C11H23NO3 — CID 135011351

IUPACN-(1-methoxybutyl)-N-(methoxymethyl)-2-methylpropanamide
SMILESCCCC(OC)N(COC)C(=O)C(C)C
InChIInChI=1S/C11H23NO3/c1-6-7-10(15-5)12(8-14-4)11(13)9(2)3/h9-10H,6-8H2,1-5H3
InChIKeyFFYDYEMWCYQRLD-UHFFFAOYSA-N
MW217.31 g/mol
LogP1.85
Rot. Bonds7

About N-(1-methoxybutyl)-N-(methoxymethyl)-2-methylpropanamide

N-(1-methoxybutyl)-N-(methoxymethyl)-2-methylpropanamide (PubChem CID 135011351) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is N-(1-methoxybutyl)-N-(methoxymethyl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(1-methoxybutyl)-N-(methoxymethyl)-2-methylpropanamide
PubChem CID135011351
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC NameN-(1-methoxybutyl)-N-(methoxymethyl)-2-methylpropanamide
SMILESCCCC(OC)N(COC)C(=O)C(C)C
InChIInChI=1S/C11H23NO3/c1-6-7-10(15-5)12(8-14-4)11(13)9(2)3/h9-10H,6-8H2,1-5H3
InChIKeyFFYDYEMWCYQRLD-UHFFFAOYSA-N
XLogP1.85
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Propanamide, N,N-dibutyl-2-methyl-
CID 253070
Propanamide, 2-methyl-N-ethyl-N-butyl-
CID 60724225
Propanamide, 2-methyl-N-ethyl-N-3-methylbutyl-
CID 91693730
N-[4-(5-fluoropentoxy)butyl]-N,2-dimethylpropanamide
CID 176934574
n,n-Bis(2-methylpropyl)butanamide
CID 243969
N-butyl-N,2-dimethylpropanamide
CID 21413636
N,2-dimethyl-N-(3-methylbutyl)propanamide
CID 60738277
N-butyl-2-methyl-N-propylpropanamide
CID 127119436
2-methyl-N-(3-methylbutyl)-N-propylpropanamide
CID 166945550
N-Isobutyl-N-(isopropoxymethyl)acetamide
CID 12066214
N,N-bis(3-methylbutyl)propanamide
CID 348848
N-(2-ethoxyethyl)-N,2-dimethylpropanamide
CID 11423854

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxybutyl)-N-(methoxymethyl)-2-methylpropanamide?
The IUPAC name of N-(1-methoxybutyl)-N-(methoxymethyl)-2-methylpropanamide (CID 135011351) is N-(1-methoxybutyl)-N-(methoxymethyl)-2-methylpropanamide.
What is the SMILES notation for N-(1-methoxybutyl)-N-(methoxymethyl)-2-methylpropanamide?
The canonical SMILES for N-(1-methoxybutyl)-N-(methoxymethyl)-2-methylpropanamide is CCCC(OC)N(COC)C(=O)C(C)C.
What is the InChIKey of N-(1-methoxybutyl)-N-(methoxymethyl)-2-methylpropanamide?
The InChIKey is FFYDYEMWCYQRLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3/c1-6-7-10(15-5)12(8-14-4)11(13)9(2)3/h9-10H,6-8H2,1-5H3.
What are the key properties of N-(1-methoxybutyl)-N-(methoxymethyl)-2-methylpropanamide?
N-(1-methoxybutyl)-N-(methoxymethyl)-2-methylpropanamide has a molecular weight of 217.31 g/mol, XLogP of 1.85, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxybutyl)-N-(methoxymethyl)-2-methylpropanamide is sourced from PubChem (CID 135011351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).