N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine

C15H26N2O2 — CID 75454323

IUPACN-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine
SMILESCc1noc(C)c1CN(C)C1CC(OC(C)(C)C)C1
InChIInChI=1S/C15H26N2O2/c1-10-14(11(2)19-16-10)9-17(6)12-7-13(8-12)18-15(3,4)5/h12-13H,7-9H2,1-6H3
InChIKeyBLQZAGJIGKUNSV-UHFFFAOYSA-N
MW266.38 g/mol
LogP3.07
Rot. Bonds4

About N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine

N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine (PubChem CID 75454323) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine.

Molecular Properties

Compound NameN-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine
PubChem CID75454323
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC NameN-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine
SMILESCc1noc(C)c1CN(C)C1CC(OC(C)(C)C)C1
InChIInChI=1S/C15H26N2O2/c1-10-14(11(2)19-16-10)9-17(6)12-7-13(8-12)18-15(3,4)5/h12-13H,7-9H2,1-6H3
InChIKeyBLQZAGJIGKUNSV-UHFFFAOYSA-N
XLogP3.07
TPSA38.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine?
The IUPAC name of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine (CID 75454323) is N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine.
What is the SMILES notation for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine?
The canonical SMILES for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine is Cc1noc(C)c1CN(C)C1CC(OC(C)(C)C)C1.
What is the InChIKey of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine?
The InChIKey is BLQZAGJIGKUNSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-10-14(11(2)19-16-10)9-17(6)12-7-13(8-12)18-15(3,4)5/h12-13H,7-9H2,1-6H3.
What are the key properties of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine?
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine has a molecular weight of 266.38 g/mol, XLogP of 3.07, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine is sourced from PubChem (CID 75454323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).