3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]propanamide

C13H26N2O2 — CID 64851177

IUPAC3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]propanamide
SMILESCC(C)COC1CC(NCCC(N)=O)C1(C)C
InChIInChI=1S/C13H26N2O2/c1-9(2)8-17-11-7-10(13(11,3)4)15-6-5-12(14)16/h9-11,15H,5-8H2,1-4H3,(H2,14,16)
InChIKeyVVLDBBZWCBYHOL-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.29
Rot. Bonds7

About 3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]propanamide

3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]propanamide (PubChem CID 64851177) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]propanamide.

Molecular Properties

Compound Name3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]propanamide
PubChem CID64851177
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]propanamide
SMILESCC(C)COC1CC(NCCC(N)=O)C1(C)C
InChIInChI=1S/C13H26N2O2/c1-9(2)8-17-11-7-10(13(11,3)4)15-6-5-12(14)16/h9-11,15H,5-8H2,1-4H3,(H2,14,16)
InChIKeyVVLDBBZWCBYHOL-UHFFFAOYSA-N
XLogP1.29
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-dimethyl-N,3-bis(2-methylpropoxy)cyclobutan-1-amine
CID 82710964
N-[3-(2-methoxyethoxy)propyl]-2,2-dimethyl-3-(2-methylpropoxy)cyclobutan-1-amine
CID 64853122
1-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]-4-methylpentan-2-ol
CID 103921147
(2S)-2-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]propanoic acid
CID 114283260
N-(2-cyclopentyloxyethyl)-2,2-dimethyl-3-(2-methylpropoxy)cyclobutan-1-amine
CID 64850404
methyl 2-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]-3-methylbutanoate
CID 64850189
N-(5-methoxypentyl)-2,2-dimethyl-3-(2-methylpropoxy)cyclobutan-1-amine
CID 103921156
N-(3-cyclopentylpropyl)-2,2-dimethyl-3-(2-methylpropoxy)cyclobutan-1-amine
CID 106008631
N-[(4-ethylcyclohexyl)methyl]-2,2-dimethyl-3-(2-methylpropoxy)cyclobutan-1-amine
CID 64852747
4-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]butanoic acid
CID 64852310
4-[[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]methyl]oxan-4-ol
CID 81130600
1-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]-2-methylpentan-2-ol
CID 103921361

Frequently Asked Questions

What is the IUPAC name of 3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]propanamide?
The IUPAC name of 3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]propanamide (CID 64851177) is 3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]propanamide.
What is the SMILES notation for 3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]propanamide?
The canonical SMILES for 3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]propanamide is CC(C)COC1CC(NCCC(N)=O)C1(C)C.
What is the InChIKey of 3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]propanamide?
The InChIKey is VVLDBBZWCBYHOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-9(2)8-17-11-7-10(13(11,3)4)15-6-5-12(14)16/h9-11,15H,5-8H2,1-4H3,(H2,14,16).
What are the key properties of 3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]propanamide?
3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]propanamide has a molecular weight of 242.36 g/mol, XLogP of 1.29, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]propanamide is sourced from PubChem (CID 64851177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).