2-methyl-2-(3-methylbutoxy)-N-propan-2-ylpropanamide

C12H25NO2 — CID 155301439

IUPAC2-methyl-2-(3-methylbutoxy)-N-propan-2-ylpropanamide
SMILESCC(C)CCOC(C)(C)C(=O)NC(C)C
InChIInChI=1S/C12H25NO2/c1-9(2)7-8-15-12(5,6)11(14)13-10(3)4/h9-10H,7-8H2,1-6H3,(H,13,14)
InChIKeyZIBGYVICIKOHIN-UHFFFAOYSA-N
MW215.34 g/mol
LogP2.35
Rot. Bonds6

About 2-methyl-2-(3-methylbutoxy)-N-propan-2-ylpropanamide

2-methyl-2-(3-methylbutoxy)-N-propan-2-ylpropanamide (PubChem CID 155301439) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is 2-methyl-2-(3-methylbutoxy)-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name2-methyl-2-(3-methylbutoxy)-N-propan-2-ylpropanamide
PubChem CID155301439
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Name2-methyl-2-(3-methylbutoxy)-N-propan-2-ylpropanamide
SMILESCC(C)CCOC(C)(C)C(=O)NC(C)C
InChIInChI=1S/C12H25NO2/c1-9(2)7-8-15-12(5,6)11(14)13-10(3)4/h9-10H,7-8H2,1-6H3,(H,13,14)
InChIKeyZIBGYVICIKOHIN-UHFFFAOYSA-N
XLogP2.35
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-2-(3-methylbutoxy)-N-pentan-3-ylpropanamide
CID 146205300
N-butan-2-yl-2-methyl-2-(3-methylbutoxy)propanamide;methanol
CID 142410133
N-[3-methyl-3-(3-methylbutoxy)butyl]propanamide
CID 147929425
2,2,4-trimethyl-N-propan-2-ylpentanamide
CID 126707660
2,2-dimethyl-N,N'-di(propan-2-yl)propanediamide
CID 108957169
4-methyl-4-(3-methylbutoxy)pentanoic acid
CID 89044410
methanamine;N-[3-methyl-3-(3-methylbutoxy)butyl]acetamide
CID 156868708
bis[1,1-bis(3-methylbutoxy)ethyl] hexanedioate
CID 164884967
2,2-difluoro-N-propan-2-ylpropanamide
CID 130495307
2,5-dimethyl-5-(3-methylbutoxy)hexan-3-one;6-methyl-5-oxoheptanamide
CID 171804821
2-methyl-2,5-bis(3-methylbutoxy)hexane
CID 90290201
2-amino-6,6-dimethyl-2-(3-methylbutoxy)heptan-4-one
CID 167018101

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(3-methylbutoxy)-N-propan-2-ylpropanamide?
The IUPAC name of 2-methyl-2-(3-methylbutoxy)-N-propan-2-ylpropanamide (CID 155301439) is 2-methyl-2-(3-methylbutoxy)-N-propan-2-ylpropanamide.
What is the SMILES notation for 2-methyl-2-(3-methylbutoxy)-N-propan-2-ylpropanamide?
The canonical SMILES for 2-methyl-2-(3-methylbutoxy)-N-propan-2-ylpropanamide is CC(C)CCOC(C)(C)C(=O)NC(C)C.
What is the InChIKey of 2-methyl-2-(3-methylbutoxy)-N-propan-2-ylpropanamide?
The InChIKey is ZIBGYVICIKOHIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-9(2)7-8-15-12(5,6)11(14)13-10(3)4/h9-10H,7-8H2,1-6H3,(H,13,14).
What are the key properties of 2-methyl-2-(3-methylbutoxy)-N-propan-2-ylpropanamide?
2-methyl-2-(3-methylbutoxy)-N-propan-2-ylpropanamide has a molecular weight of 215.34 g/mol, XLogP of 2.35, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(3-methylbutoxy)-N-propan-2-ylpropanamide is sourced from PubChem (CID 155301439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).