N-(cyclobutylmethyl)-2,2-difluoroethanamine

C7H13F2N — CID 60922535

IUPACN-(cyclobutylmethyl)-2,2-difluoroethanamine
SMILESFC(F)CNCC1CCC1
InChIInChI=1S/C7H13F2N/c8-7(9)5-10-4-6-2-1-3-6/h6-7,10H,1-5H2
InChIKeyKPYZWBAPTXFEPM-UHFFFAOYSA-N
MW149.18 g/mol
LogP1.64
Rot. Bonds4

About N-(cyclobutylmethyl)-2,2-difluoroethanamine

N-(cyclobutylmethyl)-2,2-difluoroethanamine (PubChem CID 60922535) has the molecular formula C7H13F2N and a molecular weight of 149.18 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-2,2-difluoroethanamine.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-2,2-difluoroethanamine
PubChem CID60922535
Molecular FormulaC7H13F2N
Molecular Weight149.18 g/mol
Exact Mass149.10
IUPAC NameN-(cyclobutylmethyl)-2,2-difluoroethanamine
SMILESFC(F)CNCC1CCC1
InChIInChI=1S/C7H13F2N/c8-7(9)5-10-4-6-2-1-3-6/h6-7,10H,1-5H2
InChIKeyKPYZWBAPTXFEPM-UHFFFAOYSA-N
XLogP1.64
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.18
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-2,2-difluoroethanamine?
The IUPAC name of N-(cyclobutylmethyl)-2,2-difluoroethanamine (CID 60922535) is N-(cyclobutylmethyl)-2,2-difluoroethanamine.
What is the SMILES notation for N-(cyclobutylmethyl)-2,2-difluoroethanamine?
The canonical SMILES for N-(cyclobutylmethyl)-2,2-difluoroethanamine is FC(F)CNCC1CCC1.
What is the InChIKey of N-(cyclobutylmethyl)-2,2-difluoroethanamine?
The InChIKey is KPYZWBAPTXFEPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F2N/c8-7(9)5-10-4-6-2-1-3-6/h6-7,10H,1-5H2.
What are the key properties of N-(cyclobutylmethyl)-2,2-difluoroethanamine?
N-(cyclobutylmethyl)-2,2-difluoroethanamine has a molecular weight of 149.18 g/mol, XLogP of 1.64, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-2,2-difluoroethanamine is sourced from PubChem (CID 60922535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).