2-methoxy-N-[(1-methylcyclobutyl)methyl]acetamide

C9H17NO2 — CID 103737380

IUPAC2-methoxy-N-[(1-methylcyclobutyl)methyl]acetamide
SMILESCOCC(=O)NCC1(C)CCC1
InChIInChI=1S/C9H17NO2/c1-9(4-3-5-9)7-10-8(11)6-12-2/h3-7H2,1-2H3,(H,10,11)
InChIKeyHVKGFCZVOICSLG-UHFFFAOYSA-N
MW171.24 g/mol
LogP0.94
Rot. Bonds4

About 2-methoxy-N-[(1-methylcyclobutyl)methyl]acetamide

2-methoxy-N-[(1-methylcyclobutyl)methyl]acetamide (PubChem CID 103737380) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is 2-methoxy-N-[(1-methylcyclobutyl)methyl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[(1-methylcyclobutyl)methyl]acetamide
PubChem CID103737380
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC Name2-methoxy-N-[(1-methylcyclobutyl)methyl]acetamide
SMILESCOCC(=O)NCC1(C)CCC1
InChIInChI=1S/C9H17NO2/c1-9(4-3-5-9)7-10-8(11)6-12-2/h3-7H2,1-2H3,(H,10,11)
InChIKeyHVKGFCZVOICSLG-UHFFFAOYSA-N
XLogP0.94
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(1-methylcyclobutyl)methyl]acetamide?
The IUPAC name of 2-methoxy-N-[(1-methylcyclobutyl)methyl]acetamide (CID 103737380) is 2-methoxy-N-[(1-methylcyclobutyl)methyl]acetamide.
What is the SMILES notation for 2-methoxy-N-[(1-methylcyclobutyl)methyl]acetamide?
The canonical SMILES for 2-methoxy-N-[(1-methylcyclobutyl)methyl]acetamide is COCC(=O)NCC1(C)CCC1.
What is the InChIKey of 2-methoxy-N-[(1-methylcyclobutyl)methyl]acetamide?
The InChIKey is HVKGFCZVOICSLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2/c1-9(4-3-5-9)7-10-8(11)6-12-2/h3-7H2,1-2H3,(H,10,11).
What are the key properties of 2-methoxy-N-[(1-methylcyclobutyl)methyl]acetamide?
2-methoxy-N-[(1-methylcyclobutyl)methyl]acetamide has a molecular weight of 171.24 g/mol, XLogP of 0.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(1-methylcyclobutyl)methyl]acetamide is sourced from PubChem (CID 103737380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).