2-cyclobutyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide

C13H23NO2 — CID 103840255

IUPAC2-cyclobutyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide
SMILESCN(CC1(O)CCCC1)C(=O)CC1CCC1
InChIInChI=1S/C13H23NO2/c1-14(10-13(16)7-2-3-8-13)12(15)9-11-5-4-6-11/h11,16H,2-10H2,1H3
InChIKeyIWAFIDUXSMFOJT-UHFFFAOYSA-N
MW225.33 g/mol
LogP1.94
Rot. Bonds4

About 2-cyclobutyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide

2-cyclobutyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide (PubChem CID 103840255) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is 2-cyclobutyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide.

Molecular Properties

Compound Name2-cyclobutyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide
PubChem CID103840255
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC Name2-cyclobutyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide
SMILESCN(CC1(O)CCCC1)C(=O)CC1CCC1
InChIInChI=1S/C13H23NO2/c1-14(10-13(16)7-2-3-8-13)12(15)9-11-5-4-6-11/h11,16H,2-10H2,1H3
InChIKeyIWAFIDUXSMFOJT-UHFFFAOYSA-N
XLogP1.94
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide?
The IUPAC name of 2-cyclobutyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide (CID 103840255) is 2-cyclobutyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide.
What is the SMILES notation for 2-cyclobutyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide?
The canonical SMILES for 2-cyclobutyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide is CN(CC1(O)CCCC1)C(=O)CC1CCC1.
What is the InChIKey of 2-cyclobutyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide?
The InChIKey is IWAFIDUXSMFOJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c1-14(10-13(16)7-2-3-8-13)12(15)9-11-5-4-6-11/h11,16H,2-10H2,1H3.
What are the key properties of 2-cyclobutyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide?
2-cyclobutyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide has a molecular weight of 225.33 g/mol, XLogP of 1.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide is sourced from PubChem (CID 103840255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).