N-[2-[[2-(2-phenylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide

C20H22N2O3 — CID 51153241

IUPACN-[2-[[2-(2-phenylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide
SMILESO=C(COc1ccccc1-c1ccccc1)NCCNC(=O)C1CC1
InChIInChI=1S/C20H22N2O3/c23-19(21-12-13-22-20(24)16-10-11-16)14-25-18-9-5-4-8-17(18)15-6-2-1-3-7-15/h1-9,16H,10-14H2,(H,21,23)(H,22,24)
InChIKeyPJMCQYGNALXVII-UHFFFAOYSA-N
MW338.41 g/mol
LogP2.37
Rot. Bonds8

About N-[2-[[2-(2-phenylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide

N-[2-[[2-(2-phenylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide (PubChem CID 51153241) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is N-[2-[[2-(2-phenylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-[[2-(2-phenylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide
PubChem CID51153241
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC NameN-[2-[[2-(2-phenylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide
SMILESO=C(COc1ccccc1-c1ccccc1)NCCNC(=O)C1CC1
InChIInChI=1S/C20H22N2O3/c23-19(21-12-13-22-20(24)16-10-11-16)14-25-18-9-5-4-8-17(18)15-6-2-1-3-7-15/h1-9,16H,10-14H2,(H,21,23)(H,22,24)
InChIKeyPJMCQYGNALXVII-UHFFFAOYSA-N
XLogP2.37
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[[2-(2-methylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide
CID 47102199
2-(2-phenylphenoxy)-N-propylacetamide
CID 112788813
N'-[2-(2-phenylphenoxy)acetyl]cyclohexanecarbohydrazide
CID 3465565
N-[2-[[2-(4-chloronaphthalen-1-yl)oxyacetyl]amino]ethyl]cyclopropanecarboxamide
CID 31364839
2-(2-phenylphenoxy)-N-prop-2-enylacetamide
CID 7971284
[2-oxo-2-(2-phenylethylamino)ethyl] 2-(2-phenylphenoxy)acetate
CID 8920134
N-(oxolan-2-ylmethyl)-2-(2-phenylphenoxy)acetamide
CID 18168438
N-[2-(3-phenylpropanoylamino)ethyl]cyclopropanecarboxamide
CID 51165684
N'-acetyl-2-(2-phenylphenoxy)acetohydrazide
CID 922584
2-(2-methylphenoxy)-N'-[2-(2-phenylphenoxy)acetyl]acetohydrazide
CID 5089372
1-N',4-N'-bis[2-(2-phenylphenoxy)acetyl]benzene-1,4-dicarbohydrazide
CID 3554709
3-cyclopentyl-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide
CID 7978371

Frequently Asked Questions

What is the IUPAC name of N-[2-[[2-(2-phenylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide?
The IUPAC name of N-[2-[[2-(2-phenylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide (CID 51153241) is N-[2-[[2-(2-phenylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[2-[[2-(2-phenylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide?
The canonical SMILES for N-[2-[[2-(2-phenylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide is O=C(COc1ccccc1-c1ccccc1)NCCNC(=O)C1CC1.
What is the InChIKey of N-[2-[[2-(2-phenylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide?
The InChIKey is PJMCQYGNALXVII-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3/c23-19(21-12-13-22-20(24)16-10-11-16)14-25-18-9-5-4-8-17(18)15-6-2-1-3-7-15/h1-9,16H,10-14H2,(H,21,23)(H,22,24).
What are the key properties of N-[2-[[2-(2-phenylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide?
N-[2-[[2-(2-phenylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide has a molecular weight of 338.41 g/mol, XLogP of 2.37, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[2-(2-phenylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide is sourced from PubChem (CID 51153241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).