[1-(aminomethyl)cyclobutyl]-cyclopentylmethanone

C11H19NO — CID 116600201

IUPAC[1-(aminomethyl)cyclobutyl]-cyclopentylmethanone
SMILESNCC1(C(=O)C2CCCC2)CCC1
InChIInChI=1S/C11H19NO/c12-8-11(6-3-7-11)10(13)9-4-1-2-5-9/h9H,1-8,12H2
InChIKeyUPSPHEZJXVQOMZ-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.87
Rot. Bonds3

About [1-(aminomethyl)cyclobutyl]-cyclopentylmethanone

[1-(aminomethyl)cyclobutyl]-cyclopentylmethanone (PubChem CID 116600201) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is [1-(aminomethyl)cyclobutyl]-cyclopentylmethanone.

Molecular Properties

Compound Name[1-(aminomethyl)cyclobutyl]-cyclopentylmethanone
PubChem CID116600201
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name[1-(aminomethyl)cyclobutyl]-cyclopentylmethanone
SMILESNCC1(C(=O)C2CCCC2)CCC1
InChIInChI=1S/C11H19NO/c12-8-11(6-3-7-11)10(13)9-4-1-2-5-9/h9H,1-8,12H2
InChIKeyUPSPHEZJXVQOMZ-UHFFFAOYSA-N
XLogP1.87
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-(aminomethyl)oxan-4-yl]-cyclopentylmethanone
CID 116602976
[1-(aminomethyl)cyclopentyl]-(4-ethylcyclohexyl)methanone
CID 116600979
1-(aminomethyl)cyclobutane-1-carboxylic acid
CID 23405971
[1-(aminomethyl)cyclopropyl]-(3-ethylcyclohexyl)methanone
CID 116601132
cyclopentyl 1-(aminomethyl)cyclobutane-1-carboxylate
CID 115446204
cyclohexyl-(1-prop-2-enylcyclohexyl)methanone
CID 174667942
1-[1-(aminomethyl)cyclopentyl]-2-cyclopropylethanone
CID 116601042
[1-(aminomethyl)-4-methylcyclohexyl]-(oxan-3-yl)methanone
CID 107138477
[1-(aminomethyl)cyclobutyl]-(2-methylazepan-1-yl)methanone
CID 80599736
1-[1-(aminomethyl)cycloheptyl]-2-cyclobutylethanone
CID 116602062
cyclohexyl-[1-(2-nitroethyl)cyclohexyl]methanone
CID 100967959
1-(aminomethyl)-N-(cyclobutylmethyl)cyclobutane-1-carboxamide
CID 80587767

Frequently Asked Questions

What is the IUPAC name of [1-(aminomethyl)cyclobutyl]-cyclopentylmethanone?
The IUPAC name of [1-(aminomethyl)cyclobutyl]-cyclopentylmethanone (CID 116600201) is [1-(aminomethyl)cyclobutyl]-cyclopentylmethanone.
What is the SMILES notation for [1-(aminomethyl)cyclobutyl]-cyclopentylmethanone?
The canonical SMILES for [1-(aminomethyl)cyclobutyl]-cyclopentylmethanone is NCC1(C(=O)C2CCCC2)CCC1.
What is the InChIKey of [1-(aminomethyl)cyclobutyl]-cyclopentylmethanone?
The InChIKey is UPSPHEZJXVQOMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c12-8-11(6-3-7-11)10(13)9-4-1-2-5-9/h9H,1-8,12H2.
What are the key properties of [1-(aminomethyl)cyclobutyl]-cyclopentylmethanone?
[1-(aminomethyl)cyclobutyl]-cyclopentylmethanone has a molecular weight of 181.28 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(aminomethyl)cyclobutyl]-cyclopentylmethanone is sourced from PubChem (CID 116600201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).