N-(3-ethylpentan-3-yl)-2-methoxy-2-methylpropanamide

C12H25NO2 — CID 103029185

IUPACN-(3-ethylpentan-3-yl)-2-methoxy-2-methylpropanamide
SMILESCCC(CC)(CC)NC(=O)C(C)(C)OC
InChIInChI=1S/C12H25NO2/c1-7-12(8-2,9-3)13-10(14)11(4,5)15-6/h7-9H2,1-6H3,(H,13,14)
InChIKeyDJWCNMWOGFKLJZ-UHFFFAOYSA-N
MW215.34 g/mol
LogP2.50
Rot. Bonds6

About N-(3-ethylpentan-3-yl)-2-methoxy-2-methylpropanamide

N-(3-ethylpentan-3-yl)-2-methoxy-2-methylpropanamide (PubChem CID 103029185) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is N-(3-ethylpentan-3-yl)-2-methoxy-2-methylpropanamide.

Molecular Properties

Compound NameN-(3-ethylpentan-3-yl)-2-methoxy-2-methylpropanamide
PubChem CID103029185
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC NameN-(3-ethylpentan-3-yl)-2-methoxy-2-methylpropanamide
SMILESCCC(CC)(CC)NC(=O)C(C)(C)OC
InChIInChI=1S/C12H25NO2/c1-7-12(8-2,9-3)13-10(14)11(4,5)15-6/h7-9H2,1-6H3,(H,13,14)
InChIKeyDJWCNMWOGFKLJZ-UHFFFAOYSA-N
XLogP2.50
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 ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-tert-butyl-2-methoxypropanamide
CID 112685516
N-tert-butyl-2-methoxy-2-methylpropanamide
CID 13723802
2-methoxy-N-(2-methylbutan-2-yl)acetamide
CID 60654712
N-tert-butyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 88542606
N-tert-butyl-2-methyl-2-[(2-methylpropan-2-yl)oxy]propanamide
CID 121001219
N-tert-butyl-2-propan-2-yloxypropanamide
CID 126710624
2-butan-2-yloxy-N-tert-butylpropanamide
CID 134316359
ethane;N-(3-methoxy-2,3-dimethylbutan-2-yl)acetamide
CID 144636138
N-tert-butyl-2-propoxypropanamide
CID 163439561
N-tert-butyl-2-[(2-methylpropan-2-yl)oxy]propanamide
CID 172114359
(2S)-N-tert-butyl-2-[(2-methylpropan-2-yl)oxy]propanamide
CID 177282409
(2R)-N-tert-butyl-2-[(2-methylpropan-2-yl)oxy]propanamide
CID 177282438

Frequently Asked Questions

What is the IUPAC name of N-(3-ethylpentan-3-yl)-2-methoxy-2-methylpropanamide?
The IUPAC name of N-(3-ethylpentan-3-yl)-2-methoxy-2-methylpropanamide (CID 103029185) is N-(3-ethylpentan-3-yl)-2-methoxy-2-methylpropanamide.
What is the SMILES notation for N-(3-ethylpentan-3-yl)-2-methoxy-2-methylpropanamide?
The canonical SMILES for N-(3-ethylpentan-3-yl)-2-methoxy-2-methylpropanamide is CCC(CC)(CC)NC(=O)C(C)(C)OC.
What is the InChIKey of N-(3-ethylpentan-3-yl)-2-methoxy-2-methylpropanamide?
The InChIKey is DJWCNMWOGFKLJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-7-12(8-2,9-3)13-10(14)11(4,5)15-6/h7-9H2,1-6H3,(H,13,14).
What are the key properties of N-(3-ethylpentan-3-yl)-2-methoxy-2-methylpropanamide?
N-(3-ethylpentan-3-yl)-2-methoxy-2-methylpropanamide has a molecular weight of 215.34 g/mol, XLogP of 2.50, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylpentan-3-yl)-2-methoxy-2-methylpropanamide is sourced from PubChem (CID 103029185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).