N-(3-hydroxycyclobutyl)-2-(1-methoxycyclobutyl)acetamide

C11H19NO3 — CID 103557188

IUPACN-(3-hydroxycyclobutyl)-2-(1-methoxycyclobutyl)acetamide
SMILESCOC1(CC(=O)NC2CC(O)C2)CCC1
InChIInChI=1S/C11H19NO3/c1-15-11(3-2-4-11)7-10(14)12-8-5-9(13)6-8/h8-9,13H,2-7H2,1H3,(H,12,14)
InChIKeyNYGCNKMRPMXDLP-UHFFFAOYSA-N
MW213.28 g/mol
LogP0.59
Rot. Bonds4

About N-(3-hydroxycyclobutyl)-2-(1-methoxycyclobutyl)acetamide

N-(3-hydroxycyclobutyl)-2-(1-methoxycyclobutyl)acetamide (PubChem CID 103557188) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is N-(3-hydroxycyclobutyl)-2-(1-methoxycyclobutyl)acetamide.

Molecular Properties

Compound NameN-(3-hydroxycyclobutyl)-2-(1-methoxycyclobutyl)acetamide
PubChem CID103557188
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC NameN-(3-hydroxycyclobutyl)-2-(1-methoxycyclobutyl)acetamide
SMILESCOC1(CC(=O)NC2CC(O)C2)CCC1
InChIInChI=1S/C11H19NO3/c1-15-11(3-2-4-11)7-10(14)12-8-5-9(13)6-8/h8-9,13H,2-7H2,1H3,(H,12,14)
InChIKeyNYGCNKMRPMXDLP-UHFFFAOYSA-N
XLogP0.59
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxycyclobutyl)-2-(1-methoxycyclobutyl)acetamide?
The IUPAC name of N-(3-hydroxycyclobutyl)-2-(1-methoxycyclobutyl)acetamide (CID 103557188) is N-(3-hydroxycyclobutyl)-2-(1-methoxycyclobutyl)acetamide.
What is the SMILES notation for N-(3-hydroxycyclobutyl)-2-(1-methoxycyclobutyl)acetamide?
The canonical SMILES for N-(3-hydroxycyclobutyl)-2-(1-methoxycyclobutyl)acetamide is COC1(CC(=O)NC2CC(O)C2)CCC1.
What is the InChIKey of N-(3-hydroxycyclobutyl)-2-(1-methoxycyclobutyl)acetamide?
The InChIKey is NYGCNKMRPMXDLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3/c1-15-11(3-2-4-11)7-10(14)12-8-5-9(13)6-8/h8-9,13H,2-7H2,1H3,(H,12,14).
What are the key properties of N-(3-hydroxycyclobutyl)-2-(1-methoxycyclobutyl)acetamide?
N-(3-hydroxycyclobutyl)-2-(1-methoxycyclobutyl)acetamide has a molecular weight of 213.28 g/mol, XLogP of 0.59, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxycyclobutyl)-2-(1-methoxycyclobutyl)acetamide is sourced from PubChem (CID 103557188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).