2-cyclobutyl-N-methylacetamide

C7H13NO — CID 57296172

IUPAC2-cyclobutyl-N-methylacetamide
SMILESCNC(=O)CC1CCC1
InChIInChI=1S/C7H13NO/c1-8-7(9)5-6-3-2-4-6/h6H,2-5H2,1H3,(H,8,9)
InChIKeyKHPDHIWSLKZEJZ-UHFFFAOYSA-N
MW127.19 g/mol
LogP0.92
Rot. Bonds2

About 2-cyclobutyl-N-methylacetamide

2-cyclobutyl-N-methylacetamide (PubChem CID 57296172) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is 2-cyclobutyl-N-methylacetamide.

Molecular Properties

Compound Name2-cyclobutyl-N-methylacetamide
PubChem CID57296172
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC Name2-cyclobutyl-N-methylacetamide
SMILESCNC(=O)CC1CCC1
InChIInChI=1S/C7H13NO/c1-8-7(9)5-6-3-2-4-6/h6H,2-5H2,1H3,(H,8,9)
InChIKeyKHPDHIWSLKZEJZ-UHFFFAOYSA-N
XLogP0.92
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[4-[(2-bromoacetyl)amino]cycloheptyl]-N-methylacetamide
CID 156573453
N-methyl-4-[2-(methylamino)-2-oxoethyl]cyclohexane-1-carboxamide
CID 155198720
2-cyclobutyl-N-[4-(methylamino)cyclohexyl]acetamide
CID 103162228
2-(cyclooctylmethylamino)-N-methylacetamide
CID 134293833
2-[(2-cyclohexylacetyl)amino]-N-[1-(methylamino)-1-oxopropan-2-yl]propanamide
CID 51103870
2-(3-aminocyclohexyl)-N-[2-(methylamino)-2-oxoethyl]acetamide
CID 62783174
2-(2-iodocyclopentyl)-N-methylacetamide
CID 147349767
2-(2-cyclopentylethylamino)-N-methylacetamide
CID 60919375
(2S)-2-[(2-cyclohexylacetyl)amino]propanoic acid
CID 51604978
2-cyclobutyl-N-(3,3-dimethyl-2-oxobutyl)acetamide
CID 103867639
N-(2-chloroethyl)-2-cyclobutylacetamide
CID 103164388
N-methyl-2-[1-(3,3,3-trifluoropropyl)piperidin-4-yl]acetamide
CID 50968311

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-N-methylacetamide?
The IUPAC name of 2-cyclobutyl-N-methylacetamide (CID 57296172) is 2-cyclobutyl-N-methylacetamide.
What is the SMILES notation for 2-cyclobutyl-N-methylacetamide?
The canonical SMILES for 2-cyclobutyl-N-methylacetamide is CNC(=O)CC1CCC1.
What is the InChIKey of 2-cyclobutyl-N-methylacetamide?
The InChIKey is KHPDHIWSLKZEJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO/c1-8-7(9)5-6-3-2-4-6/h6H,2-5H2,1H3,(H,8,9).
What are the key properties of 2-cyclobutyl-N-methylacetamide?
2-cyclobutyl-N-methylacetamide has a molecular weight of 127.19 g/mol, XLogP of 0.92, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-N-methylacetamide is sourced from PubChem (CID 57296172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).