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

C15H20N2O3 — CID 47102199

IUPACN-[2-[[2-(2-methylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide
SMILESCc1ccccc1OCC(=O)NCCNC(=O)C1CC1
InChIInChI=1S/C15H20N2O3/c1-11-4-2-3-5-13(11)20-10-14(18)16-8-9-17-15(19)12-6-7-12/h2-5,12H,6-10H2,1H3,(H,16,18)(H,17,19)
InChIKeyXCGAJRLHWKMMMC-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.02
Rot. Bonds7

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

N-[2-[[2-(2-methylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide (PubChem CID 47102199) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-[2-[[2-(2-methylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-[[2-(2-methylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide
PubChem CID47102199
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC NameN-[2-[[2-(2-methylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide
SMILESCc1ccccc1OCC(=O)NCCNC(=O)C1CC1
InChIInChI=1S/C15H20N2O3/c1-11-4-2-3-5-13(11)20-10-14(18)16-8-9-17-15(19)12-6-7-12/h2-5,12H,6-10H2,1H3,(H,16,18)(H,17,19)
InChIKeyXCGAJRLHWKMMMC-UHFFFAOYSA-N
XLogP1.02
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.02
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-phenylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide
CID 51153241
N-[2-(2-methylphenoxy)ethyl]cyclobutanecarboxamide
CID 113099100
N'-[2-(2-methylphenoxy)acetyl]cyclobutanecarbohydrazide
CID 8696588
N-[2-[[2-(4-chloronaphthalen-1-yl)oxyacetyl]amino]ethyl]cyclopropanecarboxamide
CID 31364839
N-[2-[[2-(3-methylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide
CID 47102238
2-(2-methylphenoxy)-N-pentylacetamide
CID 110756249
N-[(E)-1-cyclopropylethylideneamino]-2-(2-methylphenoxy)acetamide
CID 5428181
N-[(2R)-2-cyclopropyl-2-hydroxypropyl]-2-(2-methylphenoxy)acetamide
CID 52907058
3-amino-N-[2-(2-methylphenoxy)ethyl]cyclopentane-1-carboxamide
CID 119742919
N-[2-(2-hydroxyethoxy)ethyl]-2-(2-methylphenoxy)acetamide
CID 60654502
N-[2-[[2-(2,3,6-trimethylphenoxy)acetyl]amino]ethyl]cyclohexanecarboxamide
CID 108538932
N-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide
CID 18113601

Frequently Asked Questions

What is the IUPAC name of N-[2-[[2-(2-methylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide?
The IUPAC name of N-[2-[[2-(2-methylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide (CID 47102199) is N-[2-[[2-(2-methylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[2-[[2-(2-methylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide?
The canonical SMILES for N-[2-[[2-(2-methylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide is Cc1ccccc1OCC(=O)NCCNC(=O)C1CC1.
What is the InChIKey of N-[2-[[2-(2-methylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide?
The InChIKey is XCGAJRLHWKMMMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-11-4-2-3-5-13(11)20-10-14(18)16-8-9-17-15(19)12-6-7-12/h2-5,12H,6-10H2,1H3,(H,16,18)(H,17,19).
What are the key properties of N-[2-[[2-(2-methylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide?
N-[2-[[2-(2-methylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide has a molecular weight of 276.34 g/mol, XLogP of 1.02, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[2-(2-methylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide is sourced from PubChem (CID 47102199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).