N-[[1-(methylaminomethyl)cyclobutyl]methyl]-3-(oxan-4-yl)propanamide

C15H28N2O2 — CID 115272152

IUPACN-[[1-(methylaminomethyl)cyclobutyl]methyl]-3-(oxan-4-yl)propanamide
SMILESCNCC1(CNC(=O)CCC2CCOCC2)CCC1
InChIInChI=1S/C15H28N2O2/c1-16-11-15(7-2-8-15)12-17-14(18)4-3-13-5-9-19-10-6-13/h13,16H,2-12H2,1H3,(H,17,18)
InChIKeyPERUKDKGMDAEGG-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.70
Rot. Bonds7

About N-[[1-(methylaminomethyl)cyclobutyl]methyl]-3-(oxan-4-yl)propanamide

N-[[1-(methylaminomethyl)cyclobutyl]methyl]-3-(oxan-4-yl)propanamide (PubChem CID 115272152) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-[[1-(methylaminomethyl)cyclobutyl]methyl]-3-(oxan-4-yl)propanamide.

Molecular Properties

Compound NameN-[[1-(methylaminomethyl)cyclobutyl]methyl]-3-(oxan-4-yl)propanamide
PubChem CID115272152
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC NameN-[[1-(methylaminomethyl)cyclobutyl]methyl]-3-(oxan-4-yl)propanamide
SMILESCNCC1(CNC(=O)CCC2CCOCC2)CCC1
InChIInChI=1S/C15H28N2O2/c1-16-11-15(7-2-8-15)12-17-14(18)4-3-13-5-9-19-10-6-13/h13,16H,2-12H2,1H3,(H,17,18)
InChIKeyPERUKDKGMDAEGG-UHFFFAOYSA-N
XLogP1.70
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyclopentyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]propanamide
CID 115272150
4-cyclopentyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]butanamide
CID 115272161
N-[[1-(methylaminomethyl)cyclopropyl]methyl]-1-(oxan-4-yl)methanamine
CID 115244778
N-[[1-(chloromethyl)cyclohexyl]methyl]-3-cyclopentylpropanamide
CID 103969470
N-[[1-(2-chloroethyl)cyclopropyl]methyl]-3-cyclohexylpropanamide
CID 114757993
N-[[1-(methoxymethyl)cyclopentyl]methyl]-2-(oxolan-3-yl)acetamide
CID 122569101
N-[[1-(bromomethyl)cyclopropyl]methyl]-3-cyclopentylpropanamide
CID 115456298
N-(2-hydroxypropyl)-3-(oxan-4-yl)propanamide
CID 84578706
3-cyclopentyl-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]propanamide
CID 114751583
N-[3-(methylamino)propyl]-3-(oxolan-3-yl)propanamide;hydrochloride
CID 119432420
N-[[4-[(butanoylamino)methyl]oxan-4-yl]methyl]butanamide
CID 122140485
1-cyclopropyl-3-[[1-(methylaminomethyl)cyclobutyl]methyl]urea
CID 115267566

Frequently Asked Questions

What is the IUPAC name of N-[[1-(methylaminomethyl)cyclobutyl]methyl]-3-(oxan-4-yl)propanamide?
The IUPAC name of N-[[1-(methylaminomethyl)cyclobutyl]methyl]-3-(oxan-4-yl)propanamide (CID 115272152) is N-[[1-(methylaminomethyl)cyclobutyl]methyl]-3-(oxan-4-yl)propanamide.
What is the SMILES notation for N-[[1-(methylaminomethyl)cyclobutyl]methyl]-3-(oxan-4-yl)propanamide?
The canonical SMILES for N-[[1-(methylaminomethyl)cyclobutyl]methyl]-3-(oxan-4-yl)propanamide is CNCC1(CNC(=O)CCC2CCOCC2)CCC1.
What is the InChIKey of N-[[1-(methylaminomethyl)cyclobutyl]methyl]-3-(oxan-4-yl)propanamide?
The InChIKey is PERUKDKGMDAEGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-16-11-15(7-2-8-15)12-17-14(18)4-3-13-5-9-19-10-6-13/h13,16H,2-12H2,1H3,(H,17,18).
What are the key properties of N-[[1-(methylaminomethyl)cyclobutyl]methyl]-3-(oxan-4-yl)propanamide?
N-[[1-(methylaminomethyl)cyclobutyl]methyl]-3-(oxan-4-yl)propanamide has a molecular weight of 268.40 g/mol, XLogP of 1.70, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(methylaminomethyl)cyclobutyl]methyl]-3-(oxan-4-yl)propanamide is sourced from PubChem (CID 115272152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).