N-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-(1-hydroxycyclobutyl)acetamide

C13H23NO3 — CID 138013303

IUPACN-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-(1-hydroxycyclobutyl)acetamide
SMILESCCC1(CNC(=O)C(O)C2(O)CCC2)CCC1
InChIInChI=1S/C13H23NO3/c1-2-12(5-3-6-12)9-14-11(16)10(15)13(17)7-4-8-13/h10,15,17H,2-9H2,1H3,(H,14,16)
InChIKeyKSVKLGAFRHCYEO-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.96
Rot. Bonds5

About N-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-(1-hydroxycyclobutyl)acetamide

N-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-(1-hydroxycyclobutyl)acetamide (PubChem CID 138013303) has the molecular formula C13H23NO3 and a molecular weight of 241.33 g/mol. Its IUPAC name is N-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-(1-hydroxycyclobutyl)acetamide.

Molecular Properties

Compound NameN-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-(1-hydroxycyclobutyl)acetamide
PubChem CID138013303
Molecular FormulaC13H23NO3
Molecular Weight241.33 g/mol
Exact Mass241.17
IUPAC NameN-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-(1-hydroxycyclobutyl)acetamide
SMILESCCC1(CNC(=O)C(O)C2(O)CCC2)CCC1
InChIInChI=1S/C13H23NO3/c1-2-12(5-3-6-12)9-14-11(16)10(15)13(17)7-4-8-13/h10,15,17H,2-9H2,1H3,(H,14,16)
InChIKeyKSVKLGAFRHCYEO-UHFFFAOYSA-N
XLogP0.96
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-ethylcyclobutyl)methyl]-2-methyl-3-(methylamino)propanamide
CID 103810906
N-[(1-ethylcyclohexyl)methyl]-2-propylpentanamide
CID 118545273
(2S)-N-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-phenylacetamide
CID 167798849
N-[(1-ethylcyclobutyl)methyl]-2-(1-hydroxycyclohexyl)acetamide
CID 111969896
2-amino-N-[(1-ethylcyclopentyl)methyl]-3-methoxypropanamide;hydrochloride
CID 120992658
2-[(1-ethylcyclopentyl)methylamino]-2-oxoacetic acid
CID 104768310
N-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-methylpropanamide
CID 106509811
1,1-diethyl-3-[(1-ethylcyclobutyl)methyl]urea
CID 103741057
2-acetamido-N-[(1-ethylcyclopentyl)methyl]-3-sulfanylpropanamide
CID 114126114
3-[(1-ethylcyclopentyl)methyl]-1,1-dimethylurea
CID 103764918
2-amino-N-[(1-ethylcyclopentyl)methyl]acetamide
CID 103797853
2-[(1-ethylcyclobutyl)methylamino]-N-propylpropanamide
CID 103771878

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-(1-hydroxycyclobutyl)acetamide?
The IUPAC name of N-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-(1-hydroxycyclobutyl)acetamide (CID 138013303) is N-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-(1-hydroxycyclobutyl)acetamide.
What is the SMILES notation for N-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-(1-hydroxycyclobutyl)acetamide?
The canonical SMILES for N-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-(1-hydroxycyclobutyl)acetamide is CCC1(CNC(=O)C(O)C2(O)CCC2)CCC1.
What is the InChIKey of N-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-(1-hydroxycyclobutyl)acetamide?
The InChIKey is KSVKLGAFRHCYEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO3/c1-2-12(5-3-6-12)9-14-11(16)10(15)13(17)7-4-8-13/h10,15,17H,2-9H2,1H3,(H,14,16).
What are the key properties of N-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-(1-hydroxycyclobutyl)acetamide?
N-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-(1-hydroxycyclobutyl)acetamide has a molecular weight of 241.33 g/mol, XLogP of 0.96, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-(1-hydroxycyclobutyl)acetamide is sourced from PubChem (CID 138013303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).