2-(4-ethoxyphenyl)-2-(2-methylpropylamino)acetamide

C14H22N2O2 — CID 54891036

IUPAC2-(4-ethoxyphenyl)-2-(2-methylpropylamino)acetamide
SMILESCCOc1ccc(C(NCC(C)C)C(N)=O)cc1
InChIInChI=1S/C14H22N2O2/c1-4-18-12-7-5-11(6-8-12)13(14(15)17)16-9-10(2)3/h5-8,10,13,16H,4,9H2,1-3H3,(H2,15,17)
InChIKeyPNJGXKURSJYDKF-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.86
Rot. Bonds7

About 2-(4-ethoxyphenyl)-2-(2-methylpropylamino)acetamide

2-(4-ethoxyphenyl)-2-(2-methylpropylamino)acetamide (PubChem CID 54891036) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-(4-ethoxyphenyl)-2-(2-methylpropylamino)acetamide.

Molecular Properties

Compound Name2-(4-ethoxyphenyl)-2-(2-methylpropylamino)acetamide
PubChem CID54891036
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-(4-ethoxyphenyl)-2-(2-methylpropylamino)acetamide
SMILESCCOc1ccc(C(NCC(C)C)C(N)=O)cc1
InChIInChI=1S/C14H22N2O2/c1-4-18-12-7-5-11(6-8-12)13(14(15)17)16-9-10(2)3/h5-8,10,13,16H,4,9H2,1-3H3,(H2,15,17)
InChIKeyPNJGXKURSJYDKF-UHFFFAOYSA-N
XLogP1.86
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(2-amino-2-oxoethoxy)phenyl]-2-(2-methylpropylamino)acetamide
CID 60995072
2-(4-ethoxyphenyl)-2-(2-hydroxypropylamino)acetic acid
CID 82344792
ethyl 2-(2-methylpropylamino)-2-(4-propan-2-yloxyphenyl)acetate
CID 61002775
1-(4-ethoxyphenyl)-2-(2-methylpropylamino)butan-1-ol
CID 82314041
2-(4-ethoxyphenyl)-3-hydroxybutanamide
CID 152610342
2-[1-(4-ethoxyphenyl)ethylamino]propanamide
CID 43402762
1-(4-ethoxyphenyl)-2-(2-methylpropylamino)propan-1-one
CID 82100788
2-(cyclohexylamino)-2-(4-ethoxyphenyl)acetamide
CID 60998636
methyl 2-(4-ethoxyphenyl)propanoate
CID 62394502
ethyl 2-(4-ethoxyphenyl)propanoate
CID 105479148
3-(4-ethoxyphenyl)-4-methylpentanamide
CID 112508295
2-(4-bromo-3-fluorophenyl)-2-(2-methylpropylamino)acetamide
CID 81436324

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyphenyl)-2-(2-methylpropylamino)acetamide?
The IUPAC name of 2-(4-ethoxyphenyl)-2-(2-methylpropylamino)acetamide (CID 54891036) is 2-(4-ethoxyphenyl)-2-(2-methylpropylamino)acetamide.
What is the SMILES notation for 2-(4-ethoxyphenyl)-2-(2-methylpropylamino)acetamide?
The canonical SMILES for 2-(4-ethoxyphenyl)-2-(2-methylpropylamino)acetamide is CCOc1ccc(C(NCC(C)C)C(N)=O)cc1.
What is the InChIKey of 2-(4-ethoxyphenyl)-2-(2-methylpropylamino)acetamide?
The InChIKey is PNJGXKURSJYDKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-4-18-12-7-5-11(6-8-12)13(14(15)17)16-9-10(2)3/h5-8,10,13,16H,4,9H2,1-3H3,(H2,15,17).
What are the key properties of 2-(4-ethoxyphenyl)-2-(2-methylpropylamino)acetamide?
2-(4-ethoxyphenyl)-2-(2-methylpropylamino)acetamide has a molecular weight of 250.34 g/mol, XLogP of 1.86, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenyl)-2-(2-methylpropylamino)acetamide is sourced from PubChem (CID 54891036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).