2-(2-cyanophenoxy)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide

C16H20N2O3 — CID 115360382

IUPAC2-(2-cyanophenoxy)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide
SMILESN#Cc1ccccc1OCC(=O)NCC1(CO)CCCC1
InChIInChI=1S/C16H20N2O3/c17-9-13-5-1-2-6-14(13)21-10-15(20)18-11-16(12-19)7-3-4-8-16/h1-2,5-6,19H,3-4,7-8,10-12H2,(H,18,20)
InChIKeySOENRLREPRNHDC-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.61
Rot. Bonds6

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

2-(2-cyanophenoxy)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide (PubChem CID 115360382) has the molecular formula C16H20N2O3 and a molecular weight of 288.35 g/mol. Its IUPAC name is 2-(2-cyanophenoxy)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide.

Molecular Properties

Compound Name2-(2-cyanophenoxy)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide
PubChem CID115360382
Molecular FormulaC16H20N2O3
Molecular Weight288.35 g/mol
Exact Mass288.15
IUPAC Name2-(2-cyanophenoxy)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide
SMILESN#Cc1ccccc1OCC(=O)NCC1(CO)CCCC1
InChIInChI=1S/C16H20N2O3/c17-9-13-5-1-2-6-14(13)21-10-15(20)18-11-16(12-19)7-3-4-8-16/h1-2,5-6,19H,3-4,7-8,10-12H2,(H,18,20)
InChIKeySOENRLREPRNHDC-UHFFFAOYSA-N
XLogP1.61
TPSA82.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-(hydroxymethyl)cyclopentyl]methyl]-2-(2-hydroxyphenoxy)acetamide
CID 115362129
2-(2-cyanophenoxy)-N-[(1-methylcyclobutyl)methyl]acetamide
CID 103737425
2-(2-cyanophenoxy)-N-[[1-(dimethylamino)cyclobutyl]methyl]acetamide
CID 105417759
1-[[2-(2-cyanophenoxy)acetyl]amino]cyclopentane-1-carboxylic acid
CID 43351152
2-(2-cyanophenoxy)-N-[(E)-3-phenylprop-2-enyl]acetamide
CID 75407306
2-[1-[[[2-(2-hydroxyphenoxy)acetyl]amino]methyl]cyclobutyl]acetic acid
CID 81164815
2-(2-cyanophenoxy)-N-[4-(phenylcarbamoylamino)phenyl]acetamide
CID 18231496
2-(2,4-difluorophenoxy)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide
CID 115362465
N-(2-aminoethyl)-2-(2-cyanophenoxy)acetamide
CID 12841749
2-(2-cyanophenoxy)-N-(2-cyclopentylethyl)acetamide
CID 60731847
1-[2-[2-[2-(2-cyanophenoxy)acetyl]hydrazinyl]-2-oxoethyl]-3-phenylurea
CID 18292956
2-(2,3-dimethylphenoxy)-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide
CID 80716344

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanophenoxy)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide?
The IUPAC name of 2-(2-cyanophenoxy)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide (CID 115360382) is 2-(2-cyanophenoxy)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide.
What is the SMILES notation for 2-(2-cyanophenoxy)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide?
The canonical SMILES for 2-(2-cyanophenoxy)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide is N#Cc1ccccc1OCC(=O)NCC1(CO)CCCC1.
What is the InChIKey of 2-(2-cyanophenoxy)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide?
The InChIKey is SOENRLREPRNHDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3/c17-9-13-5-1-2-6-14(13)21-10-15(20)18-11-16(12-19)7-3-4-8-16/h1-2,5-6,19H,3-4,7-8,10-12H2,(H,18,20).
What are the key properties of 2-(2-cyanophenoxy)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide?
2-(2-cyanophenoxy)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide has a molecular weight of 288.35 g/mol, XLogP of 1.61, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanophenoxy)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide is sourced from PubChem (CID 115360382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).