N-methyl-N-[1-(methylaminomethyl)cyclobutyl]acetamide

C9H18N2O — CID 171105856

IUPACN-methyl-N-[1-(methylaminomethyl)cyclobutyl]acetamide
SMILESCNCC1(N(C)C(C)=O)CCC1
InChIInChI=1S/C9H18N2O/c1-8(12)11(3)9(7-10-2)5-4-6-9/h10H,4-7H2,1-3H3
InChIKeyDNIWCGNBHJYUEM-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.61
Rot. Bonds3

About N-methyl-N-[1-(methylaminomethyl)cyclobutyl]acetamide

N-methyl-N-[1-(methylaminomethyl)cyclobutyl]acetamide (PubChem CID 171105856) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is N-methyl-N-[1-(methylaminomethyl)cyclobutyl]acetamide.

Molecular Properties

Compound NameN-methyl-N-[1-(methylaminomethyl)cyclobutyl]acetamide
PubChem CID171105856
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC NameN-methyl-N-[1-(methylaminomethyl)cyclobutyl]acetamide
SMILESCNCC1(N(C)C(C)=O)CCC1
InChIInChI=1S/C9H18N2O/c1-8(12)11(3)9(7-10-2)5-4-6-9/h10H,4-7H2,1-3H3
InChIKeyDNIWCGNBHJYUEM-UHFFFAOYSA-N
XLogP0.61
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[1-(methylaminomethyl)cyclobutyl]acetamide?
The IUPAC name of N-methyl-N-[1-(methylaminomethyl)cyclobutyl]acetamide (CID 171105856) is N-methyl-N-[1-(methylaminomethyl)cyclobutyl]acetamide.
What is the SMILES notation for N-methyl-N-[1-(methylaminomethyl)cyclobutyl]acetamide?
The canonical SMILES for N-methyl-N-[1-(methylaminomethyl)cyclobutyl]acetamide is CNCC1(N(C)C(C)=O)CCC1.
What is the InChIKey of N-methyl-N-[1-(methylaminomethyl)cyclobutyl]acetamide?
The InChIKey is DNIWCGNBHJYUEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-8(12)11(3)9(7-10-2)5-4-6-9/h10H,4-7H2,1-3H3.
What are the key properties of N-methyl-N-[1-(methylaminomethyl)cyclobutyl]acetamide?
N-methyl-N-[1-(methylaminomethyl)cyclobutyl]acetamide has a molecular weight of 170.26 g/mol, XLogP of 0.61, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[1-(methylaminomethyl)cyclobutyl]acetamide is sourced from PubChem (CID 171105856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).