(18F)fluoromethane;methane;N-methoxycyclobutanamine

C7H18FNO — CID 158680230

IUPAC(18F)fluoromethane;methane;N-methoxycyclobutanamine
SMILESC.CONC1CCC1.C[18F]
InChIInChI=1S/C5H11NO.CH3F.CH4/c1-7-6-5-3-2-4-5;1-2;/h5-6H,2-4H2,1H3;1H3;1H4/i;2-1;
InChIKeyIFAKKXBPQZIBFI-SVCRYCHUSA-N
MW150.23 g/mol
LogP1.91
Rot. Bonds2

About (18F)fluoromethane;methane;N-methoxycyclobutanamine

(18F)fluoromethane;methane;N-methoxycyclobutanamine (PubChem CID 158680230) has the molecular formula C7H18FNO and a molecular weight of 150.23 g/mol. Its IUPAC name is (18F)fluoromethane;methane;N-methoxycyclobutanamine.

Molecular Properties

Compound Name(18F)fluoromethane;methane;N-methoxycyclobutanamine
PubChem CID158680230
Molecular FormulaC7H18FNO
Molecular Weight150.23 g/mol
Exact Mass150.14
IUPAC Name(18F)fluoromethane;methane;N-methoxycyclobutanamine
SMILESC.CONC1CCC1.C[18F]
InChIInChI=1S/C5H11NO.CH3F.CH4/c1-7-6-5-3-2-4-5;1-2;/h5-6H,2-4H2,1H3;1H3;1H4/i;2-1;
InChIKeyIFAKKXBPQZIBFI-SVCRYCHUSA-N
XLogP1.91
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.23
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (18F)fluoromethane;methane;N-methoxycyclobutanamine?
The IUPAC name of (18F)fluoromethane;methane;N-methoxycyclobutanamine (CID 158680230) is (18F)fluoromethane;methane;N-methoxycyclobutanamine.
What is the SMILES notation for (18F)fluoromethane;methane;N-methoxycyclobutanamine?
The canonical SMILES for (18F)fluoromethane;methane;N-methoxycyclobutanamine is C.CONC1CCC1.C[18F].
What is the InChIKey of (18F)fluoromethane;methane;N-methoxycyclobutanamine?
The InChIKey is IFAKKXBPQZIBFI-SVCRYCHUSA-N. The full InChI is InChI=1S/C5H11NO.CH3F.CH4/c1-7-6-5-3-2-4-5;1-2;/h5-6H,2-4H2,1H3;1H3;1H4/i;2-1;.
What are the key properties of (18F)fluoromethane;methane;N-methoxycyclobutanamine?
(18F)fluoromethane;methane;N-methoxycyclobutanamine has a molecular weight of 150.23 g/mol, XLogP of 1.91, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (18F)fluoromethane;methane;N-methoxycyclobutanamine is sourced from PubChem (CID 158680230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).