2-(2-cyanophenoxy)-N-[(1-methylcyclobutyl)methyl]acetamide

C15H18N2O2 — CID 103737425

IUPAC2-(2-cyanophenoxy)-N-[(1-methylcyclobutyl)methyl]acetamide
SMILESCC1(CNC(=O)COc2ccccc2C#N)CCC1
InChIInChI=1S/C15H18N2O2/c1-15(7-4-8-15)11-17-14(18)10-19-13-6-3-2-5-12(13)9-16/h2-3,5-6H,4,7-8,10-11H2,1H3,(H,17,18)
InChIKeyFBNVIFULNINEEI-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.24
Rot. Bonds5

About 2-(2-cyanophenoxy)-N-[(1-methylcyclobutyl)methyl]acetamide

2-(2-cyanophenoxy)-N-[(1-methylcyclobutyl)methyl]acetamide (PubChem CID 103737425) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-(2-cyanophenoxy)-N-[(1-methylcyclobutyl)methyl]acetamide.

Molecular Properties

Compound Name2-(2-cyanophenoxy)-N-[(1-methylcyclobutyl)methyl]acetamide
PubChem CID103737425
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name2-(2-cyanophenoxy)-N-[(1-methylcyclobutyl)methyl]acetamide
SMILESCC1(CNC(=O)COc2ccccc2C#N)CCC1
InChIInChI=1S/C15H18N2O2/c1-15(7-4-8-15)11-17-14(18)10-19-13-6-3-2-5-12(13)9-16/h2-3,5-6H,4,7-8,10-11H2,1H3,(H,17,18)
InChIKeyFBNVIFULNINEEI-UHFFFAOYSA-N
XLogP2.24
TPSA62.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanophenoxy)-N-[(1-methylcyclobutyl)methyl]acetamide?
The IUPAC name of 2-(2-cyanophenoxy)-N-[(1-methylcyclobutyl)methyl]acetamide (CID 103737425) is 2-(2-cyanophenoxy)-N-[(1-methylcyclobutyl)methyl]acetamide.
What is the SMILES notation for 2-(2-cyanophenoxy)-N-[(1-methylcyclobutyl)methyl]acetamide?
The canonical SMILES for 2-(2-cyanophenoxy)-N-[(1-methylcyclobutyl)methyl]acetamide is CC1(CNC(=O)COc2ccccc2C#N)CCC1.
What is the InChIKey of 2-(2-cyanophenoxy)-N-[(1-methylcyclobutyl)methyl]acetamide?
The InChIKey is FBNVIFULNINEEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-15(7-4-8-15)11-17-14(18)10-19-13-6-3-2-5-12(13)9-16/h2-3,5-6H,4,7-8,10-11H2,1H3,(H,17,18).
What are the key properties of 2-(2-cyanophenoxy)-N-[(1-methylcyclobutyl)methyl]acetamide?
2-(2-cyanophenoxy)-N-[(1-methylcyclobutyl)methyl]acetamide has a molecular weight of 258.32 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanophenoxy)-N-[(1-methylcyclobutyl)methyl]acetamide is sourced from PubChem (CID 103737425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).