2,2-dimethyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-(2-methylpropoxy)cyclobutan-1-amine

C14H25N3O2 — CID 106391891

IUPAC2,2-dimethyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-(2-methylpropoxy)cyclobutan-1-amine
SMILESCc1nc(CNC2CC(OCC(C)C)C2(C)C)no1
InChIInChI=1S/C14H25N3O2/c1-9(2)8-18-12-6-11(14(12,4)5)15-7-13-16-10(3)19-17-13/h9,11-12,15H,6-8H2,1-5H3
InChIKeyALYVTQZQPUBNSK-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.31
Rot. Bonds6

About 2,2-dimethyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-(2-methylpropoxy)cyclobutan-1-amine

2,2-dimethyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-(2-methylpropoxy)cyclobutan-1-amine (PubChem CID 106391891) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is 2,2-dimethyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-(2-methylpropoxy)cyclobutan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-(2-methylpropoxy)cyclobutan-1-amine
PubChem CID106391891
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC Name2,2-dimethyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-(2-methylpropoxy)cyclobutan-1-amine
SMILESCc1nc(CNC2CC(OCC(C)C)C2(C)C)no1
InChIInChI=1S/C14H25N3O2/c1-9(2)8-18-12-6-11(14(12,4)5)15-7-13-16-10(3)19-17-13/h9,11-12,15H,6-8H2,1-5H3
InChIKeyALYVTQZQPUBNSK-UHFFFAOYSA-N
XLogP2.31
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2,2-dimethyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-(2-methylpropoxy)cyclobutan-1-amine with MolForge

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Related Compounds

2,2-dimethyl-3-(2-methylpropoxy)-N-[(2-methylpyrazol-3-yl)methyl]cyclobutan-1-amine
CID 64852561
3-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]cyclobutan-1-ol
CID 107911715
1-[(1S,3R)-3-butoxy-2,2-dimethylcyclobutyl]-2-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]guanidine
CID 97056006
2,2-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]-3-(2-methylpropoxy)cyclobutan-1-amine
CID 79082844
N-[(4-ethylcyclohexyl)methyl]-2,2-dimethyl-3-(2-methylpropoxy)cyclobutan-1-amine
CID 64852747
N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]-4-methoxyaniline
CID 64853119
3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]propanamide
CID 64851177
N-(5-methoxypentyl)-2,2-dimethyl-3-(2-methylpropoxy)cyclobutan-1-amine
CID 103921156
2,6-dichloro-N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]aniline
CID 65469345
N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1-propan-2-ylazepan-4-amine
CID 106391885
N-[1-(2,5-dimethylfuran-3-yl)ethyl]-2,2-dimethyl-3-(2-methylpropoxy)cyclobutan-1-amine
CID 64851577
3-ethoxy-2,2-dimethyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]cyclobutan-1-amine
CID 103921823

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-(2-methylpropoxy)cyclobutan-1-amine?
The IUPAC name of 2,2-dimethyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-(2-methylpropoxy)cyclobutan-1-amine (CID 106391891) is 2,2-dimethyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-(2-methylpropoxy)cyclobutan-1-amine.
What is the SMILES notation for 2,2-dimethyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-(2-methylpropoxy)cyclobutan-1-amine?
The canonical SMILES for 2,2-dimethyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-(2-methylpropoxy)cyclobutan-1-amine is Cc1nc(CNC2CC(OCC(C)C)C2(C)C)no1.
What is the InChIKey of 2,2-dimethyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-(2-methylpropoxy)cyclobutan-1-amine?
The InChIKey is ALYVTQZQPUBNSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-9(2)8-18-12-6-11(14(12,4)5)15-7-13-16-10(3)19-17-13/h9,11-12,15H,6-8H2,1-5H3.
What are the key properties of 2,2-dimethyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-(2-methylpropoxy)cyclobutan-1-amine?
2,2-dimethyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-(2-methylpropoxy)cyclobutan-1-amine has a molecular weight of 267.37 g/mol, XLogP of 2.31, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-(2-methylpropoxy)cyclobutan-1-amine is sourced from PubChem (CID 106391891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).