(2R)-1-(fluoromethyl)-2-(2-methylpropyl)pyrrolidine;(2R,4R)-4-fluoro-2-(2-methylpropyl)pyrrolidine;(2R,4S)-4-fluoro-2-(2-methylpropyl)pyrrolidine;1-(3-methylbutyl)piperidine;(4R,5R)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(4R,5S)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(2R,4R)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;(2R,4S)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;2-[(2R)-2-(2-methylpropyl)pyrrolidin-1-yl]acetic acid;propane

C106H230F3N9O10S2 — CID 161178051

About (2R)-1-(fluoromethyl)-2-(2-methylpropyl)pyrrolidine;(2R,4R)-4-fluoro-2-(2-methylpropyl)pyrrolidine;(2R,4S)-4-fluoro-2-(2-methylpropyl)pyrrolidine;1-(3-methylbutyl)piperidine;(4R,5R)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(4R,5S)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(2R,4R)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;(2R,4S)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;2-[(2R)-2-(2-methylpropyl)pyrrolidin-1-yl]acetic acid;propane

(2R)-1-(fluoromethyl)-2-(2-methylpropyl)pyrrolidine;(2R,4R)-4-fluoro-2-(2-methylpropyl)pyrrolidine;(2R,4S)-4-fluoro-2-(2-methylpropyl)pyrrolidine;1-(3-methylbutyl)piperidine;(4R,5R)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(4R,5S)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(2R,4R)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;(2R,4S)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;2-[(2R)-2-(2-methylpropyl)pyrrolidin-1-yl]acetic acid;propane (PubChem CID 161178051) has the molecular formula C106H230F3N9O10S2 and a molecular weight of 1912.19 g/mol. Its IUPAC name is (2R)-1-(fluoromethyl)-2-(2-methylpropyl)pyrrolidine;(2R,4R)-4-fluoro-2-(2-methylpropyl)pyrrolidine;(2R,4S)-4-fluoro-2-(2-methylpropyl)pyrrolidine;1-(3-methylbutyl)piperidine;(4R,5R)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(4R,5S)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(2R,4R)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;(2R,4S)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;2-[(2R)-2-(2-methylpropyl)pyrrolidin-1-yl]acetic acid;propane.

Molecular Properties

• Compound Name: (2R)-1-(fluoromethyl)-2-(2-methylpropyl)pyrrolidine;(2R,4R)-4-fluoro-2-(2-methylpropyl)pyrrolidine;(2R,4S)-4-fluoro-2-(2-methylpropyl)pyrrolidine;1-(3-methylbutyl)piperidine;(4R,5R)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(4R,5S)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(2R,4R)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;(2R,4S)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;2-[(2R)-2-(2-methylpropyl)pyrrolidin-1-yl]acetic acid;propane
• PubChem CID: 161178051
• Molecular Formula: C106H230F3N9O10S2
• Molecular Weight: 1912.19 g/mol
• Exact Mass: 1910.72
• IUPAC Name: (2R)-1-(fluoromethyl)-2-(2-methylpropyl)pyrrolidine;(2R,4R)-4-fluoro-2-(2-methylpropyl)pyrrolidine;(2R,4S)-4-fluoro-2-(2-methylpropyl)pyrrolidine;1-(3-methylbutyl)piperidine;(4R,5R)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(4R,5S)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(2R,4R)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;(2R,4S)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;2-[(2R)-2-(2-methylpropyl)pyrrolidin-1-yl]acetic acid;propane
• SMILES: CC(C)CCN1CCCCC1.CC(C)C[C@@H]1C[C@@H](F)CN1.CC(C)C[C@@H]1C[C@@H](S(C)(=O)=O)CN1.CC(C)C[C@@H]1C[C@H](F)CN1.CC(C)C[C@@H]1C[C@H](S(C)(=O)=O)CN1.CC(C)C[C@H]1CCCN1CC(=O)O.CC(C)C[C@H]1CCCN1CF.CC(C)C[C@H]1NC(=O)O[C@@H]1C.CC(C)C[C@H]1NC(=O)O[C@H]1C.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC
• InChI: InChI=1S/C10H19NO2.C10H21N.C9H18FN.2C9H19NO2S.2C8H16FN.2C8H15NO2.9C3H8/c1-8(2)6-9-4-3-5-11(9)7-10(12)13;1-10(2)6-9-11-7-4-3-5-8-11;1-8(2)6-9-4-3-5-11(9)7-10;2*1-7(2)4-8-5-9(6-10-8)13(3,11)12;2*1-6(2)3-8-4-7(9)5-10-8;2*1-5(2)4-7-6(3)11-8(10)9-7;9*1-3-2/h8-9H,3-7H2,1-2H3,(H,12,13);10H,3-9H2,1-2H3;8-9H,3-7H2,1-2H3;2*7-10H,4-6H2,1-3H3;2*6-8,10H,3-5H2,1-2H3;2*5-7H,4H2,1-3H3,(H,9,10);9*3H2,1-2H3/t9-;;9-;8-,9+;8-,9-;7-,8+;7-,8-;6-,7+;6-,7-;;;;;;;;;/m1.1110101........./s1
• InChIKey: USBOYVNZWQOPOD-NAKYPNINSA-N
• XLogP: 27.41
• TPSA: 240.08 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 16
• Rotatable Bonds: 24
• Heavy Atoms: 130
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1912.19
LogP ≤ 5	27.41
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(fluoromethyl)-2-(2-methylpropyl)pyrrolidine;(2R,4R)-4-fluoro-2-(2-methylpropyl)pyrrolidine;(2R,4S)-4-fluoro-2-(2-methylpropyl)pyrrolidine;1-(3-methylbutyl)piperidine;(4R,5R)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(4R,5S)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(2R,4R)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;(2R,4S)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;2-[(2R)-2-(2-methylpropyl)pyrrolidin-1-yl]acetic acid;propane?

The IUPAC name of (2R)-1-(fluoromethyl)-2-(2-methylpropyl)pyrrolidine;(2R,4R)-4-fluoro-2-(2-methylpropyl)pyrrolidine;(2R,4S)-4-fluoro-2-(2-methylpropyl)pyrrolidine;1-(3-methylbutyl)piperidine;(4R,5R)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(4R,5S)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(2R,4R)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;(2R,4S)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;2-[(2R)-2-(2-methylpropyl)pyrrolidin-1-yl]acetic acid;propane (CID 161178051) is (2R)-1-(fluoromethyl)-2-(2-methylpropyl)pyrrolidine;(2R,4R)-4-fluoro-2-(2-methylpropyl)pyrrolidine;(2R,4S)-4-fluoro-2-(2-methylpropyl)pyrrolidine;1-(3-methylbutyl)piperidine;(4R,5R)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(4R,5S)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(2R,4R)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;(2R,4S)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;2-[(2R)-2-(2-methylpropyl)pyrrolidin-1-yl]acetic acid;propane.

What is the SMILES notation for (2R)-1-(fluoromethyl)-2-(2-methylpropyl)pyrrolidine;(2R,4R)-4-fluoro-2-(2-methylpropyl)pyrrolidine;(2R,4S)-4-fluoro-2-(2-methylpropyl)pyrrolidine;1-(3-methylbutyl)piperidine;(4R,5R)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(4R,5S)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(2R,4R)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;(2R,4S)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;2-[(2R)-2-(2-methylpropyl)pyrrolidin-1-yl]acetic acid;propane?

The canonical SMILES for (2R)-1-(fluoromethyl)-2-(2-methylpropyl)pyrrolidine;(2R,4R)-4-fluoro-2-(2-methylpropyl)pyrrolidine;(2R,4S)-4-fluoro-2-(2-methylpropyl)pyrrolidine;1-(3-methylbutyl)piperidine;(4R,5R)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(4R,5S)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(2R,4R)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;(2R,4S)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;2-[(2R)-2-(2-methylpropyl)pyrrolidin-1-yl]acetic acid;propane is CC(C)CCN1CCCCC1.CC(C)C[C@@H]1C[C@@H](F)CN1.CC(C)C[C@@H]1C[C@@H](S(C)(=O)=O)CN1.CC(C)C[C@@H]1C[C@H](F)CN1.CC(C)C[C@@H]1C[C@H](S(C)(=O)=O)CN1.CC(C)C[C@H]1CCCN1CC(=O)O.CC(C)C[C@H]1CCCN1CF.CC(C)C[C@H]1NC(=O)O[C@@H]1C.CC(C)C[C@H]1NC(=O)O[C@H]1C.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.

What is the InChIKey of (2R)-1-(fluoromethyl)-2-(2-methylpropyl)pyrrolidine;(2R,4R)-4-fluoro-2-(2-methylpropyl)pyrrolidine;(2R,4S)-4-fluoro-2-(2-methylpropyl)pyrrolidine;1-(3-methylbutyl)piperidine;(4R,5R)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(4R,5S)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(2R,4R)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;(2R,4S)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;2-[(2R)-2-(2-methylpropyl)pyrrolidin-1-yl]acetic acid;propane?

The InChIKey is USBOYVNZWQOPOD-NAKYPNINSA-N. The full InChI is InChI=1S/C10H19NO2.C10H21N.C9H18FN.2C9H19NO2S.2C8H16FN.2C8H15NO2.9C3H8/c1-8(2)6-9-4-3-5-11(9)7-10(12)13;1-10(2)6-9-11-7-4-3-5-8-11;1-8(2)6-9-4-3-5-11(9)7-10;2*1-7(2)4-8-5-9(6-10-8)13(3,11)12;2*1-6(2)3-8-4-7(9)5-10-8;2*1-5(2)4-7-6(3)11-8(10)9-7;9*1-3-2/h8-9H,3-7H2,1-2H3,(H,12,13);10H,3-9H2,1-2H3;8-9H,3-7H2,1-2H3;2*7-10H,4-6H2,1-3H3;2*6-8,10H,3-5H2,1-2H3;2*5-7H,4H2,1-3H3,(H,9,10);9*3H2,1-2H3/t9-;;9-;8-,9+;8-,9-;7-,8+;7-,8-;6-,7+;6-,7-;;;;;;;;;/m1.1110101........./s1.

What are the key properties of (2R)-1-(fluoromethyl)-2-(2-methylpropyl)pyrrolidine;(2R,4R)-4-fluoro-2-(2-methylpropyl)pyrrolidine;(2R,4S)-4-fluoro-2-(2-methylpropyl)pyrrolidine;1-(3-methylbutyl)piperidine;(4R,5R)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(4R,5S)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(2R,4R)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;(2R,4S)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;2-[(2R)-2-(2-methylpropyl)pyrrolidin-1-yl]acetic acid;propane?

(2R)-1-(fluoromethyl)-2-(2-methylpropyl)pyrrolidine;(2R,4R)-4-fluoro-2-(2-methylpropyl)pyrrolidine;(2R,4S)-4-fluoro-2-(2-methylpropyl)pyrrolidine;1-(3-methylbutyl)piperidine;(4R,5R)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(4R,5S)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(2R,4R)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;(2R,4S)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;2-[(2R)-2-(2-methylpropyl)pyrrolidin-1-yl]acetic acid;propane has a molecular weight of 1912.19 g/mol, XLogP of 27.41, 24 rotatable bonds, 7 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for (2R)-1-(fluoromethyl)-2-(2-methylpropyl)pyrrolidine;(2R,4R)-4-fluoro-2-(2-methylpropyl)pyrrolidine;(2R,4S)-4-fluoro-2-(2-methylpropyl)pyrrolidine;1-(3-methylbutyl)piperidine;(4R,5R)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(4R,5S)-5-methyl-4-(2-methylpropyl)-1,3-oxazolidin-2-one;(2R,4R)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;(2R,4S)-2-(2-methylpropyl)-4-methylsulfonylpyrrolidine;2-[(2R)-2-(2-methylpropyl)pyrrolidin-1-yl]acetic acid;propane is sourced from PubChem (CID 161178051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).