(4R)-4-(fluoromethyl)-1-methyl-2-(2-methylpropyl)pyrrolidine

C10H20FN — CID 178101320

IUPAC(4R)-4-(fluoromethyl)-1-methyl-2-(2-methylpropyl)pyrrolidine
SMILESCC(C)CC1C[C@@H](CF)CN1C
InChIInChI=1S/C10H20FN/c1-8(2)4-10-5-9(6-11)7-12(10)3/h8-10H,4-7H2,1-3H3/t9-,10?/m0/s1
InChIKeyFVWULSSGWHXVIY-RGURZIINSA-N
MW173.28 g/mol
LogP2.32
Rot. Bonds3

About (4R)-4-(fluoromethyl)-1-methyl-2-(2-methylpropyl)pyrrolidine

(4R)-4-(fluoromethyl)-1-methyl-2-(2-methylpropyl)pyrrolidine (PubChem CID 178101320) has the molecular formula C10H20FN and a molecular weight of 173.28 g/mol. Its IUPAC name is (4R)-4-(fluoromethyl)-1-methyl-2-(2-methylpropyl)pyrrolidine.

Molecular Properties

Compound Name(4R)-4-(fluoromethyl)-1-methyl-2-(2-methylpropyl)pyrrolidine
PubChem CID178101320
Molecular FormulaC10H20FN
Molecular Weight173.28 g/mol
Exact Mass173.16
IUPAC Name(4R)-4-(fluoromethyl)-1-methyl-2-(2-methylpropyl)pyrrolidine
SMILESCC(C)CC1C[C@@H](CF)CN1C
InChIInChI=1S/C10H20FN/c1-8(2)4-10-5-9(6-11)7-12(10)3/h8-10H,4-7H2,1-3H3/t9-,10?/m0/s1
InChIKeyFVWULSSGWHXVIY-RGURZIINSA-N
XLogP2.32
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.28
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4R)-4-(fluoromethyl)-1-methyl-2-(2-methylpropyl)pyrrolidine?
The IUPAC name of (4R)-4-(fluoromethyl)-1-methyl-2-(2-methylpropyl)pyrrolidine (CID 178101320) is (4R)-4-(fluoromethyl)-1-methyl-2-(2-methylpropyl)pyrrolidine.
What is the SMILES notation for (4R)-4-(fluoromethyl)-1-methyl-2-(2-methylpropyl)pyrrolidine?
The canonical SMILES for (4R)-4-(fluoromethyl)-1-methyl-2-(2-methylpropyl)pyrrolidine is CC(C)CC1C[C@@H](CF)CN1C.
What is the InChIKey of (4R)-4-(fluoromethyl)-1-methyl-2-(2-methylpropyl)pyrrolidine?
The InChIKey is FVWULSSGWHXVIY-RGURZIINSA-N. The full InChI is InChI=1S/C10H20FN/c1-8(2)4-10-5-9(6-11)7-12(10)3/h8-10H,4-7H2,1-3H3/t9-,10?/m0/s1.
What are the key properties of (4R)-4-(fluoromethyl)-1-methyl-2-(2-methylpropyl)pyrrolidine?
(4R)-4-(fluoromethyl)-1-methyl-2-(2-methylpropyl)pyrrolidine has a molecular weight of 173.28 g/mol, XLogP of 2.32, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(fluoromethyl)-1-methyl-2-(2-methylpropyl)pyrrolidine is sourced from PubChem (CID 178101320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).