N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide

C8H17NO2 — CID 54494115

IUPACN-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide
SMILESCC(=O)NCCOC(C)(C)C
InChIInChI=1S/C8H17NO2/c1-7(10)9-5-6-11-8(2,3)4/h5-6H2,1-4H3,(H,9,10)
InChIKeyMCIJDPUJPGYFBP-UHFFFAOYSA-N
MW159.23 g/mol
LogP0.94
Rot. Bonds3

About N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide

N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide (PubChem CID 54494115) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide
PubChem CID54494115
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC NameN-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide
SMILESCC(=O)NCCOC(C)(C)C
InChIInChI=1S/C8H17NO2/c1-7(10)9-5-6-11-8(2,3)4/h5-6H2,1-4H3,(H,9,10)
InChIKeyMCIJDPUJPGYFBP-UHFFFAOYSA-N
XLogP0.94
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[(2-methylpropan-2-yl)oxy]-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide
CID 134170006
S-methyl N-[2-[(2-methylpropan-2-yl)oxy]ethyl]carbamothioate
CID 139518855
3,3-dimethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]butanamide
CID 155613017
tert-butyl N-[2-[2-(2-acetamidoethoxy)ethoxy]ethyl]carbamate
CID 157037033
N-[2-[2-(2-acetamidoethoxy)ethoxy]ethyl]acetamide
CID 18674787
2-acetamidoethyl hydrogen carbonate
CID 150133482
N-[2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]propyl]acetamide
CID 155398854
N-[2-methyl-4-[(2-methylpropan-2-yl)oxy]butan-2-yl]acetamide
CID 123807188
(2S)-4-methyl-2-(methylamino)-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]pentanamide
CID 146517704
N-[3-(3-hydroxy-3-methylbutoxy)-3-methylbutyl]acetamide
CID 142467765
N-[4-(2-methoxyethylcarbamoylamino)butyl]acetamide
CID 110415978
methyl N-[2-[(2-methylpropan-2-yl)oxy]ethyl]carbamodithioate
CID 54386052

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide?
The IUPAC name of N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide (CID 54494115) is N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide.
What is the SMILES notation for N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide?
The canonical SMILES for N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide is CC(=O)NCCOC(C)(C)C.
What is the InChIKey of N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide?
The InChIKey is MCIJDPUJPGYFBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c1-7(10)9-5-6-11-8(2,3)4/h5-6H2,1-4H3,(H,9,10).
What are the key properties of N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide?
N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide has a molecular weight of 159.23 g/mol, XLogP of 0.94, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide is sourced from PubChem (CID 54494115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).