N-[2-oxo-2-(2-phenoxyanilino)ethyl]cyclopropanecarboxamide

C18H18N2O3 — CID 42697207

IUPACN-[2-oxo-2-(2-phenoxyanilino)ethyl]cyclopropanecarboxamide
SMILESO=C(CNC(=O)C1CC1)Nc1ccccc1Oc1ccccc1
InChIInChI=1S/C18H18N2O3/c21-17(12-19-18(22)13-10-11-13)20-15-8-4-5-9-16(15)23-14-6-2-1-3-7-14/h1-9,13H,10-12H2,(H,19,22)(H,20,21)
InChIKeyZDGBOQQVRKXLOR-UHFFFAOYSA-N
MW310.35 g/mol
LogP2.94
Rot. Bonds6

About N-[2-oxo-2-(2-phenoxyanilino)ethyl]cyclopropanecarboxamide

N-[2-oxo-2-(2-phenoxyanilino)ethyl]cyclopropanecarboxamide (PubChem CID 42697207) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is N-[2-oxo-2-(2-phenoxyanilino)ethyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-oxo-2-(2-phenoxyanilino)ethyl]cyclopropanecarboxamide
PubChem CID42697207
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC NameN-[2-oxo-2-(2-phenoxyanilino)ethyl]cyclopropanecarboxamide
SMILESO=C(CNC(=O)C1CC1)Nc1ccccc1Oc1ccccc1
InChIInChI=1S/C18H18N2O3/c21-17(12-19-18(22)13-10-11-13)20-15-8-4-5-9-16(15)23-14-6-2-1-3-7-14/h1-9,13H,10-12H2,(H,19,22)(H,20,21)
InChIKeyZDGBOQQVRKXLOR-UHFFFAOYSA-N
XLogP2.94
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-methoxyanilino)-2-oxoethyl]cyclopropanecarboxamide
CID 110687182
2-(cyclopropylcarbamoylamino)-N-(2-phenoxyphenyl)acetamide
CID 113000974
2-(cyclopropylamino)-N-(2-phenoxyphenyl)acetamide
CID 60647217
N-[2-(2-methoxyanilino)-2-oxoethyl]cyclobutanecarboxamide
CID 112998571
2-(2-chloroanilino)-N-(2-phenoxyphenyl)acetamide
CID 9098717
N-[2-oxo-2-(2-propan-2-yloxyanilino)ethyl]cyclohexanecarboxamide
CID 112998973
4-bromo-N-[2-oxo-2-(2-phenoxyanilino)ethyl]benzamide
CID 112771581
2-[[(1S,2S)-2-methylcyclohexyl]amino]-N-(2-phenoxyphenyl)acetamide
CID 8965725
N-(2-phenoxyphenyl)-2-phenylacetamide
CID 1121260
N-(2-methoxyphenyl)-2-(2-phenoxyanilino)acetamide
CID 7922855
N'-(4-methylphenyl)-N-[2-oxo-2-(2-phenoxyanilino)ethyl]oxamide
CID 17489902
N-cyclopropyl-2-[[2-oxo-2-(2-phenoxyanilino)ethyl]amino]benzamide
CID 18144260

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-(2-phenoxyanilino)ethyl]cyclopropanecarboxamide?
The IUPAC name of N-[2-oxo-2-(2-phenoxyanilino)ethyl]cyclopropanecarboxamide (CID 42697207) is N-[2-oxo-2-(2-phenoxyanilino)ethyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[2-oxo-2-(2-phenoxyanilino)ethyl]cyclopropanecarboxamide?
The canonical SMILES for N-[2-oxo-2-(2-phenoxyanilino)ethyl]cyclopropanecarboxamide is O=C(CNC(=O)C1CC1)Nc1ccccc1Oc1ccccc1.
What is the InChIKey of N-[2-oxo-2-(2-phenoxyanilino)ethyl]cyclopropanecarboxamide?
The InChIKey is ZDGBOQQVRKXLOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c21-17(12-19-18(22)13-10-11-13)20-15-8-4-5-9-16(15)23-14-6-2-1-3-7-14/h1-9,13H,10-12H2,(H,19,22)(H,20,21).
What are the key properties of N-[2-oxo-2-(2-phenoxyanilino)ethyl]cyclopropanecarboxamide?
N-[2-oxo-2-(2-phenoxyanilino)ethyl]cyclopropanecarboxamide has a molecular weight of 310.35 g/mol, XLogP of 2.94, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-(2-phenoxyanilino)ethyl]cyclopropanecarboxamide is sourced from PubChem (CID 42697207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).