N-methyl-N-(2,2,4,4-tetramethylpentyl)acetamide

C12H25NO — CID 170423404

IUPACN-methyl-N-(2,2,4,4-tetramethylpentyl)acetamide
SMILESCC(=O)N(C)CC(C)(C)CC(C)(C)C
InChIInChI=1S/C12H25NO/c1-10(14)13(7)9-12(5,6)8-11(2,3)4/h8-9H2,1-7H3
InChIKeyDVDAIHYCXYXXDP-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.93
Rot. Bonds3

About N-methyl-N-(2,2,4,4-tetramethylpentyl)acetamide

N-methyl-N-(2,2,4,4-tetramethylpentyl)acetamide (PubChem CID 170423404) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is N-methyl-N-(2,2,4,4-tetramethylpentyl)acetamide.

Molecular Properties

Compound NameN-methyl-N-(2,2,4,4-tetramethylpentyl)acetamide
PubChem CID170423404
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC NameN-methyl-N-(2,2,4,4-tetramethylpentyl)acetamide
SMILESCC(=O)N(C)CC(C)(C)CC(C)(C)C
InChIInChI=1S/C12H25NO/c1-10(14)13(7)9-12(5,6)8-11(2,3)4/h8-9H2,1-7H3
InChIKeyDVDAIHYCXYXXDP-UHFFFAOYSA-N
XLogP2.93
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[3-(dimethylamino)-2,2-dimethylpropyl]-N-methylacetamide
CID 20651628
N-methyl-N-(2,2,2-trifluoroethyl)acetamide
CID 59961165
N-(2,2-dimethyl-3-oxopropyl)-N-methylacetamide
CID 15555425
N-(3,3-dimethyl-2-oxobutyl)-N-methylacetamide
CID 58992304
N-methyl-N-(3,3,3-trifluoro-2,2-dihydroxypropyl)acetamide
CID 15852922
3,3-dimethylbutyl 2-[acetyl(methyl)amino]acetate
CID 78863396
2,2,4,4,6,6-hexamethylheptane
CID 2795065
ethane;N'-methyl-N-[methyl(2,2,4,4-tetramethylpentyl)amino]ethanimidamide
CID 145281180
[1-[acetyl(methyl)amino]-2-methylpropan-2-yl] aminomethyl carbonate
CID 155065549
N-methyl-N-(2-methylprop-2-enyl)acetamide
CID 115968492
N-methyl-N-(3-oxobutyl)acetamide
CID 12830531
N-ethyl-N,2,2,4,4-pentamethylpentanamide
CID 149411745

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2,2,4,4-tetramethylpentyl)acetamide?
The IUPAC name of N-methyl-N-(2,2,4,4-tetramethylpentyl)acetamide (CID 170423404) is N-methyl-N-(2,2,4,4-tetramethylpentyl)acetamide.
What is the SMILES notation for N-methyl-N-(2,2,4,4-tetramethylpentyl)acetamide?
The canonical SMILES for N-methyl-N-(2,2,4,4-tetramethylpentyl)acetamide is CC(=O)N(C)CC(C)(C)CC(C)(C)C.
What is the InChIKey of N-methyl-N-(2,2,4,4-tetramethylpentyl)acetamide?
The InChIKey is DVDAIHYCXYXXDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-10(14)13(7)9-12(5,6)8-11(2,3)4/h8-9H2,1-7H3.
What are the key properties of N-methyl-N-(2,2,4,4-tetramethylpentyl)acetamide?
N-methyl-N-(2,2,4,4-tetramethylpentyl)acetamide has a molecular weight of 199.34 g/mol, XLogP of 2.93, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2,2,4,4-tetramethylpentyl)acetamide is sourced from PubChem (CID 170423404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).