4-(fluoromethyl)-3-methylpyrrolidin-3-amine

C6H13FN2 — CID 19837181

IUPAC4-(fluoromethyl)-3-methylpyrrolidin-3-amine
SMILESCC1(N)CNCC1CF
InChIInChI=1S/C6H13FN2/c1-6(8)4-9-3-5(6)2-7/h5,9H,2-4,8H2,1H3
InChIKeyRPWFYWLKEBZHLR-UHFFFAOYSA-N
MW132.18 g/mol
LogP-0.11
Rot. Bonds1

About 4-(fluoromethyl)-3-methylpyrrolidin-3-amine

4-(fluoromethyl)-3-methylpyrrolidin-3-amine (PubChem CID 19837181) has the molecular formula C6H13FN2 and a molecular weight of 132.18 g/mol. Its IUPAC name is 4-(fluoromethyl)-3-methylpyrrolidin-3-amine.

Molecular Properties

Compound Name4-(fluoromethyl)-3-methylpyrrolidin-3-amine
PubChem CID19837181
Molecular FormulaC6H13FN2
Molecular Weight132.18 g/mol
Exact Mass132.11
IUPAC Name4-(fluoromethyl)-3-methylpyrrolidin-3-amine
SMILESCC1(N)CNCC1CF
InChIInChI=1S/C6H13FN2/c1-6(8)4-9-3-5(6)2-7/h5,9H,2-4,8H2,1H3
InChIKeyRPWFYWLKEBZHLR-UHFFFAOYSA-N
XLogP-0.11
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.18
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(fluoromethyl)-3-methylpyrrolidin-3-amine?
The IUPAC name of 4-(fluoromethyl)-3-methylpyrrolidin-3-amine (CID 19837181) is 4-(fluoromethyl)-3-methylpyrrolidin-3-amine.
What is the SMILES notation for 4-(fluoromethyl)-3-methylpyrrolidin-3-amine?
The canonical SMILES for 4-(fluoromethyl)-3-methylpyrrolidin-3-amine is CC1(N)CNCC1CF.
What is the InChIKey of 4-(fluoromethyl)-3-methylpyrrolidin-3-amine?
The InChIKey is RPWFYWLKEBZHLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13FN2/c1-6(8)4-9-3-5(6)2-7/h5,9H,2-4,8H2,1H3.
What are the key properties of 4-(fluoromethyl)-3-methylpyrrolidin-3-amine?
4-(fluoromethyl)-3-methylpyrrolidin-3-amine has a molecular weight of 132.18 g/mol, XLogP of -0.11, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(fluoromethyl)-3-methylpyrrolidin-3-amine is sourced from PubChem (CID 19837181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).