(3S)-N-(2-fluoroethyl)-N,1,5,5-tetramethylpyrrolidin-3-amine

C10H21FN2 — CID 166869739

IUPAC(3S)-N-(2-fluoroethyl)-N,1,5,5-tetramethylpyrrolidin-3-amine
SMILESCN(CCF)[C@@H]1CN(C)C(C)(C)C1
InChIInChI=1S/C10H21FN2/c1-10(2)7-9(8-13(10)4)12(3)6-5-11/h9H,5-8H2,1-4H3/t9-/m0/s1
InChIKeyPPWLFQQZKMIIFY-VIFPVBQESA-N
MW188.29 g/mol
LogP1.37
Rot. Bonds3

About (3S)-N-(2-fluoroethyl)-N,1,5,5-tetramethylpyrrolidin-3-amine

(3S)-N-(2-fluoroethyl)-N,1,5,5-tetramethylpyrrolidin-3-amine (PubChem CID 166869739) has the molecular formula C10H21FN2 and a molecular weight of 188.29 g/mol. Its IUPAC name is (3S)-N-(2-fluoroethyl)-N,1,5,5-tetramethylpyrrolidin-3-amine.

Molecular Properties

Compound Name(3S)-N-(2-fluoroethyl)-N,1,5,5-tetramethylpyrrolidin-3-amine
PubChem CID166869739
Molecular FormulaC10H21FN2
Molecular Weight188.29 g/mol
Exact Mass188.17
IUPAC Name(3S)-N-(2-fluoroethyl)-N,1,5,5-tetramethylpyrrolidin-3-amine
SMILESCN(CCF)[C@@H]1CN(C)C(C)(C)C1
InChIInChI=1S/C10H21FN2/c1-10(2)7-9(8-13(10)4)12(3)6-5-11/h9H,5-8H2,1-4H3/t9-/m0/s1
InChIKeyPPWLFQQZKMIIFY-VIFPVBQESA-N
XLogP1.37
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.29
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (3S)-N-(2-fluoroethyl)-N,1,5,5-tetramethylpyrrolidin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3S)-N-(2-fluoroethyl)-N,1,5,5-tetramethylpyrrolidin-3-amine?
The IUPAC name of (3S)-N-(2-fluoroethyl)-N,1,5,5-tetramethylpyrrolidin-3-amine (CID 166869739) is (3S)-N-(2-fluoroethyl)-N,1,5,5-tetramethylpyrrolidin-3-amine.
What is the SMILES notation for (3S)-N-(2-fluoroethyl)-N,1,5,5-tetramethylpyrrolidin-3-amine?
The canonical SMILES for (3S)-N-(2-fluoroethyl)-N,1,5,5-tetramethylpyrrolidin-3-amine is CN(CCF)[C@@H]1CN(C)C(C)(C)C1.
What is the InChIKey of (3S)-N-(2-fluoroethyl)-N,1,5,5-tetramethylpyrrolidin-3-amine?
The InChIKey is PPWLFQQZKMIIFY-VIFPVBQESA-N. The full InChI is InChI=1S/C10H21FN2/c1-10(2)7-9(8-13(10)4)12(3)6-5-11/h9H,5-8H2,1-4H3/t9-/m0/s1.
What are the key properties of (3S)-N-(2-fluoroethyl)-N,1,5,5-tetramethylpyrrolidin-3-amine?
(3S)-N-(2-fluoroethyl)-N,1,5,5-tetramethylpyrrolidin-3-amine has a molecular weight of 188.29 g/mol, XLogP of 1.37, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N-(2-fluoroethyl)-N,1,5,5-tetramethylpyrrolidin-3-amine is sourced from PubChem (CID 166869739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).