[1-(methylaminomethyl)cyclobutyl]-(1-methylpiperidin-4-yl)methanone

C13H24N2O — CID 116921797

IUPAC[1-(methylaminomethyl)cyclobutyl]-(1-methylpiperidin-4-yl)methanone
SMILESCNCC1(C(=O)C2CCN(C)CC2)CCC1
InChIInChI=1S/C13H24N2O/c1-14-10-13(6-3-7-13)12(16)11-4-8-15(2)9-5-11/h11,14H,3-10H2,1-2H3
InChIKeyWOXZOVLCGXTZMO-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.29
Rot. Bonds4

About [1-(methylaminomethyl)cyclobutyl]-(1-methylpiperidin-4-yl)methanone

[1-(methylaminomethyl)cyclobutyl]-(1-methylpiperidin-4-yl)methanone (PubChem CID 116921797) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is [1-(methylaminomethyl)cyclobutyl]-(1-methylpiperidin-4-yl)methanone.

Molecular Properties

Compound Name[1-(methylaminomethyl)cyclobutyl]-(1-methylpiperidin-4-yl)methanone
PubChem CID116921797
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name[1-(methylaminomethyl)cyclobutyl]-(1-methylpiperidin-4-yl)methanone
SMILESCNCC1(C(=O)C2CCN(C)CC2)CCC1
InChIInChI=1S/C13H24N2O/c1-14-10-13(6-3-7-13)12(16)11-4-8-15(2)9-5-11/h11,14H,3-10H2,1-2H3
InChIKeyWOXZOVLCGXTZMO-UHFFFAOYSA-N
XLogP1.29
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(hydroxymethyl)cyclopropyl]-(1-methylpyrrolidin-3-yl)methanone
CID 116921208
1-(hydroxymethyl)-N-(1-methylpiperidin-4-yl)cyclobutane-1-carboxamide
CID 115183966
methyl 1-[(1-methylpiperidin-4-yl)methyl]cyclobutane-1-carboxylate
CID 116929765
N-(cyclopentylmethyl)-1-(methylaminomethyl)cyclobutane-1-carboxamide
CID 115183725
N,1-dimethylpiperidine-4-carboxamide;ethane
CID 156719814
1-[[(1-methylpiperidin-4-yl)methylcarbamoylamino]methyl]cyclobutane-1-carboxylic acid
CID 115446682
N-methyl-1-[1-[3-(1-methylpiperidin-4-yl)oxetan-3-yl]cyclobutyl]methanamine
CID 116874978
2,2-dimethyl-1-[1-(methylaminomethyl)cyclobutyl]propan-1-one
CID 116921693
N-methyl-1-(methylaminomethyl)-N-[2-(1-methylpyrrolidin-3-yl)ethyl]cyclopropane-1-carboxamide
CID 115183166
(3,3-difluoropyrrolidin-1-yl)-[1-(methylaminomethyl)cyclobutyl]methanone
CID 116991766
[1-(aminomethyl)cyclobutyl]-cyclopentylmethanone
CID 116600201
3-(1-methylpiperidine-4-carbonyl)oxetane-3-carbonitrile
CID 116922347

Frequently Asked Questions

What is the IUPAC name of [1-(methylaminomethyl)cyclobutyl]-(1-methylpiperidin-4-yl)methanone?
The IUPAC name of [1-(methylaminomethyl)cyclobutyl]-(1-methylpiperidin-4-yl)methanone (CID 116921797) is [1-(methylaminomethyl)cyclobutyl]-(1-methylpiperidin-4-yl)methanone.
What is the SMILES notation for [1-(methylaminomethyl)cyclobutyl]-(1-methylpiperidin-4-yl)methanone?
The canonical SMILES for [1-(methylaminomethyl)cyclobutyl]-(1-methylpiperidin-4-yl)methanone is CNCC1(C(=O)C2CCN(C)CC2)CCC1.
What is the InChIKey of [1-(methylaminomethyl)cyclobutyl]-(1-methylpiperidin-4-yl)methanone?
The InChIKey is WOXZOVLCGXTZMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-14-10-13(6-3-7-13)12(16)11-4-8-15(2)9-5-11/h11,14H,3-10H2,1-2H3.
What are the key properties of [1-(methylaminomethyl)cyclobutyl]-(1-methylpiperidin-4-yl)methanone?
[1-(methylaminomethyl)cyclobutyl]-(1-methylpiperidin-4-yl)methanone has a molecular weight of 224.35 g/mol, XLogP of 1.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(methylaminomethyl)cyclobutyl]-(1-methylpiperidin-4-yl)methanone is sourced from PubChem (CID 116921797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).