ethane;2-methyl-2-(4-methylphenoxy)propanamide

C13H21NO2 — CID 145199634

IUPACethane;2-methyl-2-(4-methylphenoxy)propanamide
SMILESCC.Cc1ccc(OC(C)(C)C(N)=O)cc1
InChIInChI=1S/C11H15NO2.C2H6/c1-8-4-6-9(7-5-8)14-11(2,3)10(12)13;1-2/h4-7H,1-3H3,(H2,12,13);1-2H3
InChIKeyFKEOEYUJHKDPQC-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.66
Rot. Bonds3

About ethane;2-methyl-2-(4-methylphenoxy)propanamide

ethane;2-methyl-2-(4-methylphenoxy)propanamide (PubChem CID 145199634) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is ethane;2-methyl-2-(4-methylphenoxy)propanamide.

Molecular Properties

Compound Nameethane;2-methyl-2-(4-methylphenoxy)propanamide
PubChem CID145199634
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC Nameethane;2-methyl-2-(4-methylphenoxy)propanamide
SMILESCC.Cc1ccc(OC(C)(C)C(N)=O)cc1
InChIInChI=1S/C11H15NO2.C2H6/c1-8-4-6-9(7-5-8)14-11(2,3)10(12)13;1-2/h4-7H,1-3H3,(H2,12,13);1-2H3
InChIKeyFKEOEYUJHKDPQC-UHFFFAOYSA-N
XLogP2.66
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;2-methyl-2-(4-methylphenoxy)propanamide?
The IUPAC name of ethane;2-methyl-2-(4-methylphenoxy)propanamide (CID 145199634) is ethane;2-methyl-2-(4-methylphenoxy)propanamide.
What is the SMILES notation for ethane;2-methyl-2-(4-methylphenoxy)propanamide?
The canonical SMILES for ethane;2-methyl-2-(4-methylphenoxy)propanamide is CC.Cc1ccc(OC(C)(C)C(N)=O)cc1.
What is the InChIKey of ethane;2-methyl-2-(4-methylphenoxy)propanamide?
The InChIKey is FKEOEYUJHKDPQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2.C2H6/c1-8-4-6-9(7-5-8)14-11(2,3)10(12)13;1-2/h4-7H,1-3H3,(H2,12,13);1-2H3.
What are the key properties of ethane;2-methyl-2-(4-methylphenoxy)propanamide?
ethane;2-methyl-2-(4-methylphenoxy)propanamide has a molecular weight of 223.32 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methyl-2-(4-methylphenoxy)propanamide is sourced from PubChem (CID 145199634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).