N-fluoropropan-2-amine

C3H8FN — CID 15525477

IUPACN-fluoropropan-2-amine
SMILESCC(C)NF
InChIInChI=1S/C3H8FN/c1-3(2)5-4/h3,5H,1-2H3
InChIKeyVGIITZLXVAKVGK-UHFFFAOYSA-N
MW77.10 g/mol
LogP0.87
Rot. Bonds1

About N-fluoropropan-2-amine

N-fluoropropan-2-amine (PubChem CID 15525477) has the molecular formula C3H8FN and a molecular weight of 77.10 g/mol. Its IUPAC name is N-fluoropropan-2-amine.

Molecular Properties

Compound NameN-fluoropropan-2-amine
PubChem CID15525477
Molecular FormulaC3H8FN
Molecular Weight77.10 g/mol
Exact Mass77.06
IUPAC NameN-fluoropropan-2-amine
SMILESCC(C)NF
InChIInChI=1S/C3H8FN/c1-3(2)5-4/h3,5H,1-2H3
InChIKeyVGIITZLXVAKVGK-UHFFFAOYSA-N
XLogP0.87
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50077.10
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Sec-Butylamine
CID 24874
Isopropylamine
CID 6363
2-Butanamine, (S)-
CID 6713753
(R)-sec-butylamine
CID 2724537
2-Propanamine, hydrochloride (1:1)
CID 6432137
Isopropylaminium
CID 3364502
Isopropylammonium chloride
CID 27399
2-Propanamine, 1-fluoro-, (2S)-
CID 11851334
(2S)-1-fluoropropan-2-amine hydrochloride
CID 11851333
Isopropyl-d7-amine
CID 12203880
Iso-propyl-1,1,1,3,3,3-D6-amine
CID 12203884
1-Fluoropropan-2-amine hydrochloride
CID 23143594

Frequently Asked Questions

What is the IUPAC name of N-fluoropropan-2-amine?
The IUPAC name of N-fluoropropan-2-amine (CID 15525477) is N-fluoropropan-2-amine.
What is the SMILES notation for N-fluoropropan-2-amine?
The canonical SMILES for N-fluoropropan-2-amine is CC(C)NF.
What is the InChIKey of N-fluoropropan-2-amine?
The InChIKey is VGIITZLXVAKVGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8FN/c1-3(2)5-4/h3,5H,1-2H3.
What are the key properties of N-fluoropropan-2-amine?
N-fluoropropan-2-amine has a molecular weight of 77.10 g/mol, XLogP of 0.87, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-fluoropropan-2-amine is sourced from PubChem (CID 15525477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).