N-(cyclobutylmethyl)-2-(3-hydroxyphenyl)-N-methylacetamide

C14H19NO2 — CID 55126003

IUPACN-(cyclobutylmethyl)-2-(3-hydroxyphenyl)-N-methylacetamide
SMILESCN(CC1CCC1)C(=O)Cc1cccc(O)c1
InChIInChI=1S/C14H19NO2/c1-15(10-11-4-2-5-11)14(17)9-12-6-3-7-13(16)8-12/h3,6-8,11,16H,2,4-5,9-10H2,1H3
InChIKeyURAAIAHXCFRENR-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.19
Rot. Bonds4

About N-(cyclobutylmethyl)-2-(3-hydroxyphenyl)-N-methylacetamide

N-(cyclobutylmethyl)-2-(3-hydroxyphenyl)-N-methylacetamide (PubChem CID 55126003) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-2-(3-hydroxyphenyl)-N-methylacetamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-2-(3-hydroxyphenyl)-N-methylacetamide
PubChem CID55126003
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC NameN-(cyclobutylmethyl)-2-(3-hydroxyphenyl)-N-methylacetamide
SMILESCN(CC1CCC1)C(=O)Cc1cccc(O)c1
InChIInChI=1S/C14H19NO2/c1-15(10-11-4-2-5-11)14(17)9-12-6-3-7-13(16)8-12/h3,6-8,11,16H,2,4-5,9-10H2,1H3
InChIKeyURAAIAHXCFRENR-UHFFFAOYSA-N
XLogP2.19
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3-bromocyclobutyl)methyl]-2-(3-hydroxyphenyl)-N-methylacetamide
CID 80673108
N-methyl-N-(oxan-4-ylmethyl)-2-phenylacetamide
CID 110752415
2-(4-cyanophenyl)-N-(cyclobutylmethyl)-N-methylacetamide
CID 63611364
2-(3-hydroxyphenyl)-N-methyl-N-[(4-methylphenyl)methyl]acetamide
CID 61399859
2-(3-hydroxyphenyl)-N-(piperidin-4-ylmethyl)-N-propylacetamide
CID 79702214
1-(2,6-dimethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone
CID 61399740
2-amino-N-(cyclobutylmethyl)-5-hydroxy-N-methylbenzamide
CID 107075183
N-ethyl-2-(3-hydroxyphenyl)-N-(oxolan-2-ylmethyl)acetamide
CID 61435069
N-[(3-bromocyclobutyl)methyl]-2-(3-chlorophenyl)-N-methylacetamide
CID 80672572
N-[2-(3,5-dimethylpyrazolidin-4-yl)ethyl]-2-(3-hydroxyphenyl)-N-methylacetamide
CID 133108337
N-benzyl-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide
CID 71935827
N-(3-aminopropyl)-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide
CID 61399131

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-2-(3-hydroxyphenyl)-N-methylacetamide?
The IUPAC name of N-(cyclobutylmethyl)-2-(3-hydroxyphenyl)-N-methylacetamide (CID 55126003) is N-(cyclobutylmethyl)-2-(3-hydroxyphenyl)-N-methylacetamide.
What is the SMILES notation for N-(cyclobutylmethyl)-2-(3-hydroxyphenyl)-N-methylacetamide?
The canonical SMILES for N-(cyclobutylmethyl)-2-(3-hydroxyphenyl)-N-methylacetamide is CN(CC1CCC1)C(=O)Cc1cccc(O)c1.
What is the InChIKey of N-(cyclobutylmethyl)-2-(3-hydroxyphenyl)-N-methylacetamide?
The InChIKey is URAAIAHXCFRENR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-15(10-11-4-2-5-11)14(17)9-12-6-3-7-13(16)8-12/h3,6-8,11,16H,2,4-5,9-10H2,1H3.
What are the key properties of N-(cyclobutylmethyl)-2-(3-hydroxyphenyl)-N-methylacetamide?
N-(cyclobutylmethyl)-2-(3-hydroxyphenyl)-N-methylacetamide has a molecular weight of 233.31 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-2-(3-hydroxyphenyl)-N-methylacetamide is sourced from PubChem (CID 55126003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).