1-[3-(fluoromethyl)pyrrolidin-3-yl]-N-methylmethanamine

C7H15FN2 — CID 22903673

IUPAC1-[3-(fluoromethyl)pyrrolidin-3-yl]-N-methylmethanamine
SMILESCNCC1(CF)CCNC1
InChIInChI=1S/C7H15FN2/c1-9-5-7(4-8)2-3-10-6-7/h9-10H,2-6H2,1H3
InChIKeyGOTMKEJIVUNAKM-UHFFFAOYSA-N
MW146.21 g/mol
LogP0.16
Rot. Bonds3

About 1-[3-(fluoromethyl)pyrrolidin-3-yl]-N-methylmethanamine

1-[3-(fluoromethyl)pyrrolidin-3-yl]-N-methylmethanamine (PubChem CID 22903673) has the molecular formula C7H15FN2 and a molecular weight of 146.21 g/mol. Its IUPAC name is 1-[3-(fluoromethyl)pyrrolidin-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-(fluoromethyl)pyrrolidin-3-yl]-N-methylmethanamine
PubChem CID22903673
Molecular FormulaC7H15FN2
Molecular Weight146.21 g/mol
Exact Mass146.12
IUPAC Name1-[3-(fluoromethyl)pyrrolidin-3-yl]-N-methylmethanamine
SMILESCNCC1(CF)CCNC1
InChIInChI=1S/C7H15FN2/c1-9-5-7(4-8)2-3-10-6-7/h9-10H,2-6H2,1H3
InChIKeyGOTMKEJIVUNAKM-UHFFFAOYSA-N
XLogP0.16
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.21
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[3-(fluoromethyl)pyrrolidin-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[3-(fluoromethyl)pyrrolidin-3-yl]-N-methylmethanamine (CID 22903673) is 1-[3-(fluoromethyl)pyrrolidin-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-(fluoromethyl)pyrrolidin-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[3-(fluoromethyl)pyrrolidin-3-yl]-N-methylmethanamine is CNCC1(CF)CCNC1.
What is the InChIKey of 1-[3-(fluoromethyl)pyrrolidin-3-yl]-N-methylmethanamine?
The InChIKey is GOTMKEJIVUNAKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15FN2/c1-9-5-7(4-8)2-3-10-6-7/h9-10H,2-6H2,1H3.
What are the key properties of 1-[3-(fluoromethyl)pyrrolidin-3-yl]-N-methylmethanamine?
1-[3-(fluoromethyl)pyrrolidin-3-yl]-N-methylmethanamine has a molecular weight of 146.21 g/mol, XLogP of 0.16, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(fluoromethyl)pyrrolidin-3-yl]-N-methylmethanamine is sourced from PubChem (CID 22903673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).