4-fluoro-1,2-dimethyl-2-(2-methylpropyl)pyrrolidine

C10H20FN — CID 166984291

IUPAC4-fluoro-1,2-dimethyl-2-(2-methylpropyl)pyrrolidine
SMILESCC(C)CC1(C)CC(F)CN1C
InChIInChI=1S/C10H20FN/c1-8(2)5-10(3)6-9(11)7-12(10)4/h8-9H,5-7H2,1-4H3
InChIKeyQUTQVZKZAKBEOY-UHFFFAOYSA-N
MW173.27 g/mol
LogP2.46
Rot. Bonds2

About 4-fluoro-1,2-dimethyl-2-(2-methylpropyl)pyrrolidine

4-fluoro-1,2-dimethyl-2-(2-methylpropyl)pyrrolidine (PubChem CID 166984291) has the molecular formula C10H20FN and a molecular weight of 173.27 g/mol. Its IUPAC name is 4-fluoro-1,2-dimethyl-2-(2-methylpropyl)pyrrolidine.

Molecular Properties

Compound Name4-fluoro-1,2-dimethyl-2-(2-methylpropyl)pyrrolidine
PubChem CID166984291
Molecular FormulaC10H20FN
Molecular Weight173.27 g/mol
Exact Mass173.16
IUPAC Name4-fluoro-1,2-dimethyl-2-(2-methylpropyl)pyrrolidine
SMILESCC(C)CC1(C)CC(F)CN1C
InChIInChI=1S/C10H20FN/c1-8(2)5-10(3)6-9(11)7-12(10)4/h8-9H,5-7H2,1-4H3
InChIKeyQUTQVZKZAKBEOY-UHFFFAOYSA-N
XLogP2.46
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.27
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1,2-dimethyl-2-(2-methylpropyl)pyrrolidine?
The IUPAC name of 4-fluoro-1,2-dimethyl-2-(2-methylpropyl)pyrrolidine (CID 166984291) is 4-fluoro-1,2-dimethyl-2-(2-methylpropyl)pyrrolidine.
What is the SMILES notation for 4-fluoro-1,2-dimethyl-2-(2-methylpropyl)pyrrolidine?
The canonical SMILES for 4-fluoro-1,2-dimethyl-2-(2-methylpropyl)pyrrolidine is CC(C)CC1(C)CC(F)CN1C.
What is the InChIKey of 4-fluoro-1,2-dimethyl-2-(2-methylpropyl)pyrrolidine?
The InChIKey is QUTQVZKZAKBEOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20FN/c1-8(2)5-10(3)6-9(11)7-12(10)4/h8-9H,5-7H2,1-4H3.
What are the key properties of 4-fluoro-1,2-dimethyl-2-(2-methylpropyl)pyrrolidine?
4-fluoro-1,2-dimethyl-2-(2-methylpropyl)pyrrolidine has a molecular weight of 173.27 g/mol, XLogP of 2.46, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1,2-dimethyl-2-(2-methylpropyl)pyrrolidine is sourced from PubChem (CID 166984291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).