2-[cyclobutylmethyl(methyl)amino]-1-cyclopentylethanone

C13H23NO — CID 104750664

IUPAC2-[cyclobutylmethyl(methyl)amino]-1-cyclopentylethanone
SMILESCN(CC(=O)C1CCCC1)CC1CCC1
InChIInChI=1S/C13H23NO/c1-14(9-11-5-4-6-11)10-13(15)12-7-2-3-8-12/h11-12H,2-10H2,1H3
InChIKeyAKCCLIUQWNFFED-UHFFFAOYSA-N
MW209.33 g/mol
LogP2.48
Rot. Bonds5

About 2-[cyclobutylmethyl(methyl)amino]-1-cyclopentylethanone

2-[cyclobutylmethyl(methyl)amino]-1-cyclopentylethanone (PubChem CID 104750664) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is 2-[cyclobutylmethyl(methyl)amino]-1-cyclopentylethanone.

Molecular Properties

Compound Name2-[cyclobutylmethyl(methyl)amino]-1-cyclopentylethanone
PubChem CID104750664
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Name2-[cyclobutylmethyl(methyl)amino]-1-cyclopentylethanone
SMILESCN(CC(=O)C1CCCC1)CC1CCC1
InChIInChI=1S/C13H23NO/c1-14(9-11-5-4-6-11)10-13(15)12-7-2-3-8-12/h11-12H,2-10H2,1H3
InChIKeyAKCCLIUQWNFFED-UHFFFAOYSA-N
XLogP2.48
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[cyclohexylmethyl(methyl)amino]-1-cyclopentylethanone
CID 104750162
1-cyclohexyl-2-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]ethanone
CID 113448833
2-[cyclobutylmethyl(methyl)amino]-1-(oxolan-3-yl)ethanone
CID 104750663
2-[(2-cyclopentyl-2-oxoethyl)-methylamino]-N,N-dimethylacetamide
CID 104750391
1-cyclopentyl-2-[methyl(propyl)amino]ethanone
CID 104750008
1-[cyclobutylmethyl(methyl)amino]-3,3-dimethylbutan-2-one
CID 62862391
2-[cyclohexylmethyl(methyl)amino]-N-cyclopentyl-N-cyclopropylacetamide
CID 112841265
1-[cyclohexylmethyl(methyl)amino]-3-methylbutan-2-one
CID 79395083
1-cyclohexyl-2-[cyclopropylmethyl(ethyl)amino]ethanone
CID 104750812
1-cyclohexyl-2-[(2-hydroxy-2-methylpropyl)-methylamino]ethanone
CID 104750928
2-[cyclopentylmethyl(methyl)amino]-N-methyl-N-propan-2-ylacetamide
CID 86869723
1-cyclopentyl-2-[2-(cyclopropylmethoxy)ethyl-methylamino]ethanone
CID 104750980

Frequently Asked Questions

What is the IUPAC name of 2-[cyclobutylmethyl(methyl)amino]-1-cyclopentylethanone?
The IUPAC name of 2-[cyclobutylmethyl(methyl)amino]-1-cyclopentylethanone (CID 104750664) is 2-[cyclobutylmethyl(methyl)amino]-1-cyclopentylethanone.
What is the SMILES notation for 2-[cyclobutylmethyl(methyl)amino]-1-cyclopentylethanone?
The canonical SMILES for 2-[cyclobutylmethyl(methyl)amino]-1-cyclopentylethanone is CN(CC(=O)C1CCCC1)CC1CCC1.
What is the InChIKey of 2-[cyclobutylmethyl(methyl)amino]-1-cyclopentylethanone?
The InChIKey is AKCCLIUQWNFFED-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO/c1-14(9-11-5-4-6-11)10-13(15)12-7-2-3-8-12/h11-12H,2-10H2,1H3.
What are the key properties of 2-[cyclobutylmethyl(methyl)amino]-1-cyclopentylethanone?
2-[cyclobutylmethyl(methyl)amino]-1-cyclopentylethanone has a molecular weight of 209.33 g/mol, XLogP of 2.48, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclobutylmethyl(methyl)amino]-1-cyclopentylethanone is sourced from PubChem (CID 104750664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).