2,2-difluoro-N-propan-2-yloxetan-3-amine

C6H11F2NO — CID 164821377

IUPAC2,2-difluoro-N-propan-2-yloxetan-3-amine
SMILESCC(C)NC1COC1(F)F
InChIInChI=1S/C6H11F2NO/c1-4(2)9-5-3-10-6(5,7)8/h4-5,9H,3H2,1-2H3
InChIKeyUDIMYZQRTKFNMD-UHFFFAOYSA-N
MW151.16 g/mol
LogP0.98
Rot. Bonds2

About 2,2-difluoro-N-propan-2-yloxetan-3-amine

2,2-difluoro-N-propan-2-yloxetan-3-amine (PubChem CID 164821377) has the molecular formula C6H11F2NO and a molecular weight of 151.16 g/mol. Its IUPAC name is 2,2-difluoro-N-propan-2-yloxetan-3-amine.

Molecular Properties

Compound Name2,2-difluoro-N-propan-2-yloxetan-3-amine
PubChem CID164821377
Molecular FormulaC6H11F2NO
Molecular Weight151.16 g/mol
Exact Mass151.08
IUPAC Name2,2-difluoro-N-propan-2-yloxetan-3-amine
SMILESCC(C)NC1COC1(F)F
InChIInChI=1S/C6H11F2NO/c1-4(2)9-5-3-10-6(5,7)8/h4-5,9H,3H2,1-2H3
InChIKeyUDIMYZQRTKFNMD-UHFFFAOYSA-N
XLogP0.98
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N-propan-2-yloxetan-3-amine?
The IUPAC name of 2,2-difluoro-N-propan-2-yloxetan-3-amine (CID 164821377) is 2,2-difluoro-N-propan-2-yloxetan-3-amine.
What is the SMILES notation for 2,2-difluoro-N-propan-2-yloxetan-3-amine?
The canonical SMILES for 2,2-difluoro-N-propan-2-yloxetan-3-amine is CC(C)NC1COC1(F)F.
What is the InChIKey of 2,2-difluoro-N-propan-2-yloxetan-3-amine?
The InChIKey is UDIMYZQRTKFNMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F2NO/c1-4(2)9-5-3-10-6(5,7)8/h4-5,9H,3H2,1-2H3.
What are the key properties of 2,2-difluoro-N-propan-2-yloxetan-3-amine?
2,2-difluoro-N-propan-2-yloxetan-3-amine has a molecular weight of 151.16 g/mol, XLogP of 0.98, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N-propan-2-yloxetan-3-amine is sourced from PubChem (CID 164821377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).