N-[1-(hydroxymethyl)cyclobutyl]-2-(2-methoxyphenoxy)acetamide

C14H19NO4 — CID 115878022

IUPACN-[1-(hydroxymethyl)cyclobutyl]-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)NC1(CO)CCC1
InChIInChI=1S/C14H19NO4/c1-18-11-5-2-3-6-12(11)19-9-13(17)15-14(10-16)7-4-8-14/h2-3,5-6,16H,4,7-10H2,1H3,(H,15,17)
InChIKeyCMNCDIGVFJIIHJ-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.11
Rot. Bonds6

About N-[1-(hydroxymethyl)cyclobutyl]-2-(2-methoxyphenoxy)acetamide

N-[1-(hydroxymethyl)cyclobutyl]-2-(2-methoxyphenoxy)acetamide (PubChem CID 115878022) has the molecular formula C14H19NO4 and a molecular weight of 265.31 g/mol. Its IUPAC name is N-[1-(hydroxymethyl)cyclobutyl]-2-(2-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-[1-(hydroxymethyl)cyclobutyl]-2-(2-methoxyphenoxy)acetamide
PubChem CID115878022
Molecular FormulaC14H19NO4
Molecular Weight265.31 g/mol
Exact Mass265.13
IUPAC NameN-[1-(hydroxymethyl)cyclobutyl]-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)NC1(CO)CCC1
InChIInChI=1S/C14H19NO4/c1-18-11-5-2-3-6-12(11)19-9-13(17)15-14(10-16)7-4-8-14/h2-3,5-6,16H,4,7-10H2,1H3,(H,15,17)
InChIKeyCMNCDIGVFJIIHJ-UHFFFAOYSA-N
XLogP1.11
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(hydroxymethyl)cyclobutyl]-2-methoxybenzamide
CID 113344829
2-(2,6-dimethylphenoxy)-N-[1-(hydroxymethyl)cyclopentyl]acetamide
CID 62517015
2-[1-[[2-(2-phenylmethoxyphenoxy)acetyl]amino]cyclobutyl]acetic acid
CID 119217220
1-[[2-(2-methoxyphenoxy)acetyl]amino]-2-phenylcyclopropane-1-carboxylic acid
CID 84559632
2-(2-methoxyphenoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide
CID 18128274
N-[1-(hydroxymethyl)cyclobutyl]-2-(2,4,6-trimethylphenoxy)acetamide
CID 115878097
2-(2,4-difluorophenoxy)-N-[1-(hydroxymethyl)cyclopentyl]acetamide
CID 62519487
N-[[1-(dimethylamino)cyclohexyl]methyl]-2-(2-methoxyphenoxy)acetamide;hydrochloride
CID 20995004
(2S)-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanoic acid
CID 746811
2-(2-fluorophenoxy)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide
CID 103954074
N-[1-(aminomethyl)cyclopentyl]-3-(2-methoxyphenoxy)propanamide
CID 119565773
N-[1-(aminomethyl)cyclopentyl]-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride
CID 119565633

Frequently Asked Questions

What is the IUPAC name of N-[1-(hydroxymethyl)cyclobutyl]-2-(2-methoxyphenoxy)acetamide?
The IUPAC name of N-[1-(hydroxymethyl)cyclobutyl]-2-(2-methoxyphenoxy)acetamide (CID 115878022) is N-[1-(hydroxymethyl)cyclobutyl]-2-(2-methoxyphenoxy)acetamide.
What is the SMILES notation for N-[1-(hydroxymethyl)cyclobutyl]-2-(2-methoxyphenoxy)acetamide?
The canonical SMILES for N-[1-(hydroxymethyl)cyclobutyl]-2-(2-methoxyphenoxy)acetamide is COc1ccccc1OCC(=O)NC1(CO)CCC1.
What is the InChIKey of N-[1-(hydroxymethyl)cyclobutyl]-2-(2-methoxyphenoxy)acetamide?
The InChIKey is CMNCDIGVFJIIHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO4/c1-18-11-5-2-3-6-12(11)19-9-13(17)15-14(10-16)7-4-8-14/h2-3,5-6,16H,4,7-10H2,1H3,(H,15,17).
What are the key properties of N-[1-(hydroxymethyl)cyclobutyl]-2-(2-methoxyphenoxy)acetamide?
N-[1-(hydroxymethyl)cyclobutyl]-2-(2-methoxyphenoxy)acetamide has a molecular weight of 265.31 g/mol, XLogP of 1.11, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(hydroxymethyl)cyclobutyl]-2-(2-methoxyphenoxy)acetamide is sourced from PubChem (CID 115878022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).