N,N,1,1,2,2,3,3,3-nonafluoropropan-1-amine

C3F9N — CID 10900163

IUPACN,N,1,1,2,2,3,3,3-nonafluoropropan-1-amine
SMILESFN(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C3F9N/c4-1(5,2(6,7)8)3(9,10)13(11)12
InChIKeyHQBCITPSUTXPTN-UHFFFAOYSA-N
MW221.02 g/mol
LogP2.85
Rot. Bonds2

About N,N,1,1,2,2,3,3,3-nonafluoropropan-1-amine

N,N,1,1,2,2,3,3,3-nonafluoropropan-1-amine (PubChem CID 10900163) has the molecular formula C3F9N and a molecular weight of 221.02 g/mol. Its IUPAC name is N,N,1,1,2,2,3,3,3-nonafluoropropan-1-amine.

Molecular Properties

Compound NameN,N,1,1,2,2,3,3,3-nonafluoropropan-1-amine
PubChem CID10900163
Molecular FormulaC3F9N
Molecular Weight221.02 g/mol
Exact Mass220.99
IUPAC NameN,N,1,1,2,2,3,3,3-nonafluoropropan-1-amine
SMILESFN(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C3F9N/c4-1(5,2(6,7)8)3(9,10)13(11)12
InChIKeyHQBCITPSUTXPTN-UHFFFAOYSA-N
XLogP2.85
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.02
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}, {'alert_name': 'N-halo', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N,1,1,2,2,3,3,3-nonafluoropropan-1-amine?
The IUPAC name of N,N,1,1,2,2,3,3,3-nonafluoropropan-1-amine (CID 10900163) is N,N,1,1,2,2,3,3,3-nonafluoropropan-1-amine.
What is the SMILES notation for N,N,1,1,2,2,3,3,3-nonafluoropropan-1-amine?
The canonical SMILES for N,N,1,1,2,2,3,3,3-nonafluoropropan-1-amine is FN(F)C(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of N,N,1,1,2,2,3,3,3-nonafluoropropan-1-amine?
The InChIKey is HQBCITPSUTXPTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C3F9N/c4-1(5,2(6,7)8)3(9,10)13(11)12.
What are the key properties of N,N,1,1,2,2,3,3,3-nonafluoropropan-1-amine?
N,N,1,1,2,2,3,3,3-nonafluoropropan-1-amine has a molecular weight of 221.02 g/mol, XLogP of 2.85, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,1,1,2,2,3,3,3-nonafluoropropan-1-amine is sourced from PubChem (CID 10900163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).