3-methoxy-N-propan-2-yl-N-[(1-propan-2-ylazetidin-3-yl)methyl]cyclobutan-1-amine

C15H30N2O — CID 134440963

IUPAC3-methoxy-N-propan-2-yl-N-[(1-propan-2-ylazetidin-3-yl)methyl]cyclobutan-1-amine
SMILESCOC1CC(N(CC2CN(C(C)C)C2)C(C)C)C1
InChIInChI=1S/C15H30N2O/c1-11(2)16-8-13(9-16)10-17(12(3)4)14-6-15(7-14)18-5/h11-15H,6-10H2,1-5H3
InChIKeyZLFYBLONONLIQN-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.21
Rot. Bonds6

About 3-methoxy-N-propan-2-yl-N-[(1-propan-2-ylazetidin-3-yl)methyl]cyclobutan-1-amine

3-methoxy-N-propan-2-yl-N-[(1-propan-2-ylazetidin-3-yl)methyl]cyclobutan-1-amine (PubChem CID 134440963) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 3-methoxy-N-propan-2-yl-N-[(1-propan-2-ylazetidin-3-yl)methyl]cyclobutan-1-amine.

Molecular Properties

Compound Name3-methoxy-N-propan-2-yl-N-[(1-propan-2-ylazetidin-3-yl)methyl]cyclobutan-1-amine
PubChem CID134440963
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name3-methoxy-N-propan-2-yl-N-[(1-propan-2-ylazetidin-3-yl)methyl]cyclobutan-1-amine
SMILESCOC1CC(N(CC2CN(C(C)C)C2)C(C)C)C1
InChIInChI=1S/C15H30N2O/c1-11(2)16-8-13(9-16)10-17(12(3)4)14-6-15(7-14)18-5/h11-15H,6-10H2,1-5H3
InChIKeyZLFYBLONONLIQN-UHFFFAOYSA-N
XLogP2.21
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-propan-2-yl-N-[(1-propan-2-ylazetidin-3-yl)methyl]cyclobutan-1-amine?
The IUPAC name of 3-methoxy-N-propan-2-yl-N-[(1-propan-2-ylazetidin-3-yl)methyl]cyclobutan-1-amine (CID 134440963) is 3-methoxy-N-propan-2-yl-N-[(1-propan-2-ylazetidin-3-yl)methyl]cyclobutan-1-amine.
What is the SMILES notation for 3-methoxy-N-propan-2-yl-N-[(1-propan-2-ylazetidin-3-yl)methyl]cyclobutan-1-amine?
The canonical SMILES for 3-methoxy-N-propan-2-yl-N-[(1-propan-2-ylazetidin-3-yl)methyl]cyclobutan-1-amine is COC1CC(N(CC2CN(C(C)C)C2)C(C)C)C1.
What is the InChIKey of 3-methoxy-N-propan-2-yl-N-[(1-propan-2-ylazetidin-3-yl)methyl]cyclobutan-1-amine?
The InChIKey is ZLFYBLONONLIQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-11(2)16-8-13(9-16)10-17(12(3)4)14-6-15(7-14)18-5/h11-15H,6-10H2,1-5H3.
What are the key properties of 3-methoxy-N-propan-2-yl-N-[(1-propan-2-ylazetidin-3-yl)methyl]cyclobutan-1-amine?
3-methoxy-N-propan-2-yl-N-[(1-propan-2-ylazetidin-3-yl)methyl]cyclobutan-1-amine has a molecular weight of 254.42 g/mol, XLogP of 2.21, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-propan-2-yl-N-[(1-propan-2-ylazetidin-3-yl)methyl]cyclobutan-1-amine is sourced from PubChem (CID 134440963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).