N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]-1-methylpyrrolidin-3-amine

C15H30N2O — CID 64851962

IUPACN-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]-1-methylpyrrolidin-3-amine
SMILESCC(C)COC1CC(NC2CCN(C)C2)C1(C)C
InChIInChI=1S/C15H30N2O/c1-11(2)10-18-14-8-13(15(14,3)4)16-12-6-7-17(5)9-12/h11-14,16H,6-10H2,1-5H3
InChIKeyOOVZQSRMXXFXPH-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.12
Rot. Bonds5

About N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]-1-methylpyrrolidin-3-amine

N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]-1-methylpyrrolidin-3-amine (PubChem CID 64851962) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]-1-methylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]-1-methylpyrrolidin-3-amine
PubChem CID64851962
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]-1-methylpyrrolidin-3-amine
SMILESCC(C)COC1CC(NC2CCN(C)C2)C1(C)C
InChIInChI=1S/C15H30N2O/c1-11(2)10-18-14-8-13(15(14,3)4)16-12-6-7-17(5)9-12/h11-14,16H,6-10H2,1-5H3
InChIKeyOOVZQSRMXXFXPH-UHFFFAOYSA-N
XLogP2.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]-1,1-dioxothiolan-3-amine
CID 64851363
2,2-dimethyl-3-[(1-methylpyrrolidin-3-yl)amino]cyclobutan-1-ol
CID 112633891
N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]thian-3-amine
CID 115906102
2,2-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]-3-(2-methylpropoxy)cyclobutan-1-amine
CID 79082844
2,2-dimethyl-N,3-bis(2-methylpropoxy)cyclobutan-1-amine
CID 82710964
N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]bicyclo[2.2.1]heptan-2-amine
CID 64852165
3-ethoxy-2,2-dimethyl-N-[(1-methylpyrrolidin-3-yl)methyl]cyclobutan-1-amine
CID 64852708
N-(3-cyclopentylpropyl)-2,2-dimethyl-3-(2-methylpropoxy)cyclobutan-1-amine
CID 106008631
N-(3-ethoxy-2,2-dimethylcyclobutyl)-4-ethylcyclohexan-1-amine
CID 64851352
N-(2-cyclopentyloxyethyl)-2,2-dimethyl-3-(2-methylpropoxy)cyclobutan-1-amine
CID 64850404
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

Frequently Asked Questions

What is the IUPAC name of N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]-1-methylpyrrolidin-3-amine?
The IUPAC name of N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]-1-methylpyrrolidin-3-amine (CID 64851962) is N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]-1-methylpyrrolidin-3-amine.
What is the SMILES notation for N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]-1-methylpyrrolidin-3-amine?
The canonical SMILES for N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]-1-methylpyrrolidin-3-amine is CC(C)COC1CC(NC2CCN(C)C2)C1(C)C.
What is the InChIKey of N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]-1-methylpyrrolidin-3-amine?
The InChIKey is OOVZQSRMXXFXPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-11(2)10-18-14-8-13(15(14,3)4)16-12-6-7-17(5)9-12/h11-14,16H,6-10H2,1-5H3.
What are the key properties of N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]-1-methylpyrrolidin-3-amine?
N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]-1-methylpyrrolidin-3-amine has a molecular weight of 254.42 g/mol, XLogP of 2.12, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]-1-methylpyrrolidin-3-amine is sourced from PubChem (CID 64851962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).