ethane;N-ethyl-N-(4-methylphenyl)acetamide

C13H21NO — CID 143607666

IUPACethane;N-ethyl-N-(4-methylphenyl)acetamide
SMILESCC.CCN(C(C)=O)c1ccc(C)cc1
InChIInChI=1S/C11H15NO.C2H6/c1-4-12(10(3)13)11-7-5-9(2)6-8-11;1-2/h5-8H,4H2,1-3H3;1-2H3
InChIKeyHACNHQNEDUGCHD-UHFFFAOYSA-N
MW207.32 g/mol
LogP3.39
Rot. Bonds2

About ethane;N-ethyl-N-(4-methylphenyl)acetamide

ethane;N-ethyl-N-(4-methylphenyl)acetamide (PubChem CID 143607666) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is ethane;N-ethyl-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Nameethane;N-ethyl-N-(4-methylphenyl)acetamide
PubChem CID143607666
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC Nameethane;N-ethyl-N-(4-methylphenyl)acetamide
SMILESCC.CCN(C(C)=O)c1ccc(C)cc1
InChIInChI=1S/C11H15NO.C2H6/c1-4-12(10(3)13)11-7-5-9(2)6-8-11;1-2/h5-8H,4H2,1-3H3;1-2H3
InChIKeyHACNHQNEDUGCHD-UHFFFAOYSA-N
XLogP3.39
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethyl-2-methyl-N-(4-methylphenyl)propanamide
CID 60737044
N-ethyl-N-(4-methylphenyl)-3-sulfanylpropanamide
CID 107027712
(2R)-2-amino-N-ethyl-N-(4-methylphenyl)propanamide
CID 78979225
3-(N-acetyl-4-methylanilino)propanamide
CID 21238865
N-ethyl-N-(4-methylphenyl)-2-propoxyacetamide
CID 113227387
3-bromo-N-ethyl-N-(4-methylphenyl)prop-2-ynamide
CID 130707368
ethane;N-methyl-N-(4-methylphenyl)acetamide
CID 143974566
2-(2-aminoethoxy)-N-ethyl-N-(4-methylphenyl)acetamide
CID 79479435
ethyl-(4-methylphenyl)carbamodithioic acid
CID 154283267
N-ethyl-N-(4-propylsulfonylphenyl)acetamide
CID 110172517
N-ethyl-N-(4-methylphenyl)azepane-1-carboxamide
CID 116655376
2-cyano-N-ethyl-N-(4-methylphenyl)propanamide
CID 55207914

Frequently Asked Questions

What is the IUPAC name of ethane;N-ethyl-N-(4-methylphenyl)acetamide?
The IUPAC name of ethane;N-ethyl-N-(4-methylphenyl)acetamide (CID 143607666) is ethane;N-ethyl-N-(4-methylphenyl)acetamide.
What is the SMILES notation for ethane;N-ethyl-N-(4-methylphenyl)acetamide?
The canonical SMILES for ethane;N-ethyl-N-(4-methylphenyl)acetamide is CC.CCN(C(C)=O)c1ccc(C)cc1.
What is the InChIKey of ethane;N-ethyl-N-(4-methylphenyl)acetamide?
The InChIKey is HACNHQNEDUGCHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO.C2H6/c1-4-12(10(3)13)11-7-5-9(2)6-8-11;1-2/h5-8H,4H2,1-3H3;1-2H3.
What are the key properties of ethane;N-ethyl-N-(4-methylphenyl)acetamide?
ethane;N-ethyl-N-(4-methylphenyl)acetamide has a molecular weight of 207.32 g/mol, XLogP of 3.39, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-ethyl-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 143607666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).