4-fluoro-1-propan-2-ylpyrrolidin-3-amine;2-(propan-2-ylamino)ethanol;2-[2-(propan-2-ylamino)ethylamino]ethanol;3-propan-2-ylazetidine;(1-propan-2-ylazetidin-3-yl) dihydrogen phosphate;(1-propan-2-ylazetidin-3-yl)methanamine;(1-propan-2-ylazetidin-3-yl)methanol;2-(1-propan-2-ylazetidin-3-yl)oxypyridine;propan-2-ylcyclopentane;1-propan-2-ylpiperidin-3-amine;1-propan-2-ylpiperidin-4-amine;1-propan-2-ylpiperidine-4-carbonitrile;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpiperidin-4-ol;1-propan-2-ylpyrrolidin-3-amine

C112H238FN22O10P — CID 158496547

About 4-fluoro-1-propan-2-ylpyrrolidin-3-amine;2-(propan-2-ylamino)ethanol;2-[2-(propan-2-ylamino)ethylamino]ethanol;3-propan-2-ylazetidine;(1-propan-2-ylazetidin-3-yl) dihydrogen phosphate;(1-propan-2-ylazetidin-3-yl)methanamine;(1-propan-2-ylazetidin-3-yl)methanol;2-(1-propan-2-ylazetidin-3-yl)oxypyridine;propan-2-ylcyclopentane;1-propan-2-ylpiperidin-3-amine;1-propan-2-ylpiperidin-4-amine;1-propan-2-ylpiperidine-4-carbonitrile;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpiperidin-4-ol;1-propan-2-ylpyrrolidin-3-amine

4-fluoro-1-propan-2-ylpyrrolidin-3-amine;2-(propan-2-ylamino)ethanol;2-[2-(propan-2-ylamino)ethylamino]ethanol;3-propan-2-ylazetidine;(1-propan-2-ylazetidin-3-yl) dihydrogen phosphate;(1-propan-2-ylazetidin-3-yl)methanamine;(1-propan-2-ylazetidin-3-yl)methanol;2-(1-propan-2-ylazetidin-3-yl)oxypyridine;propan-2-ylcyclopentane;1-propan-2-ylpiperidin-3-amine;1-propan-2-ylpiperidin-4-amine;1-propan-2-ylpiperidine-4-carbonitrile;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpiperidin-4-ol;1-propan-2-ylpyrrolidin-3-amine (PubChem CID 158496547) has the molecular formula C112H238FN22O10P and a molecular weight of 2103.25 g/mol. Its IUPAC name is 4-fluoro-1-propan-2-ylpyrrolidin-3-amine;2-(propan-2-ylamino)ethanol;2-[2-(propan-2-ylamino)ethylamino]ethanol;3-propan-2-ylazetidine;(1-propan-2-ylazetidin-3-yl) dihydrogen phosphate;(1-propan-2-ylazetidin-3-yl)methanamine;(1-propan-2-ylazetidin-3-yl)methanol;2-(1-propan-2-ylazetidin-3-yl)oxypyridine;propan-2-ylcyclopentane;1-propan-2-ylpiperidin-3-amine;1-propan-2-ylpiperidin-4-amine;1-propan-2-ylpiperidine-4-carbonitrile;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpiperidin-4-ol;1-propan-2-ylpyrrolidin-3-amine.

Molecular Properties

• Compound Name: 4-fluoro-1-propan-2-ylpyrrolidin-3-amine;2-(propan-2-ylamino)ethanol;2-[2-(propan-2-ylamino)ethylamino]ethanol;3-propan-2-ylazetidine;(1-propan-2-ylazetidin-3-yl) dihydrogen phosphate;(1-propan-2-ylazetidin-3-yl)methanamine;(1-propan-2-ylazetidin-3-yl)methanol;2-(1-propan-2-ylazetidin-3-yl)oxypyridine;propan-2-ylcyclopentane;1-propan-2-ylpiperidin-3-amine;1-propan-2-ylpiperidin-4-amine;1-propan-2-ylpiperidine-4-carbonitrile;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpiperidin-4-ol;1-propan-2-ylpyrrolidin-3-amine
• PubChem CID: 158496547
• Molecular Formula: C112H238FN22O10P
• Molecular Weight: 2103.25 g/mol
• Exact Mass: 2101.85
• IUPAC Name: 4-fluoro-1-propan-2-ylpyrrolidin-3-amine;2-(propan-2-ylamino)ethanol;2-[2-(propan-2-ylamino)ethylamino]ethanol;3-propan-2-ylazetidine;(1-propan-2-ylazetidin-3-yl) dihydrogen phosphate;(1-propan-2-ylazetidin-3-yl)methanamine;(1-propan-2-ylazetidin-3-yl)methanol;2-(1-propan-2-ylazetidin-3-yl)oxypyridine;propan-2-ylcyclopentane;1-propan-2-ylpiperidin-3-amine;1-propan-2-ylpiperidin-4-amine;1-propan-2-ylpiperidine-4-carbonitrile;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpiperidin-4-ol;1-propan-2-ylpyrrolidin-3-amine
• SMILES: CC(C)C1CCCC1.CC(C)C1CNC1.CC(C)N1CC(CN)C1.CC(C)N1CC(CO)C1.CC(C)N1CC(N)C(F)C1.CC(C)N1CC(OP(=O)(O)O)C1.CC(C)N1CC(Oc2ccccn2)C1.CC(C)N1CCC(C#N)CC1.CC(C)N1CCC(N)C1.CC(C)N1CCC(N)CC1.CC(C)N1CCC(O)CC1.CC(C)N1CCCC(N)C1.CC(C)N1CCCC(O)C1.CC(C)NCCNCCO.CC(C)NCCO
• InChI: InChI=1S/C11H16N2O.C9H16N2.2C8H18N2.2C8H17NO.C8H16.C7H15FN2.C7H18N2O.2C7H16N2.C7H15NO.C6H14NO4P.C6H13N.C5H13NO/c1-9(2)13-7-10(8-13)14-11-5-3-4-6-12-11;1-8(2)11-5-3-9(7-10)4-6-11;1-7(2)10-5-3-8(9)4-6-10;1-7(2)10-5-3-4-8(9)6-10;1-7(2)9-5-3-8(10)4-6-9;1-7(2)9-5-3-4-8(10)6-9;1-7(2)8-5-3-4-6-8;1-5(2)10-3-6(8)7(9)4-10;1-7(2)9-4-3-8-5-6-10;1-6(2)9-4-7(3-8)5-9;1-6(2)9-4-3-7(8)5-9;1-6(2)8-3-7(4-8)5-9;1-5(2)7-3-6(4-7)11-12(8,9)10;1-5(2)6-3-7-4-6;1-5(2)6-3-4-7/h3-6,9-10H,7-8H2,1-2H3;8-9H,3-6H2,1-2H3;2*7-8H,3-6,9H2,1-2H3;2*7-8,10H,3-6H2,1-2H3;7-8H,3-6H2,1-2H3;5-7H,3-4,9H2,1-2H3;7-10H,3-6H2,1-2H3;2*6-7H,3-5,8H2,1-2H3;6-7,9H,3-5H2,1-2H3;5-6H,3-4H2,1-2H3,(H2,8,9,10);2*5-7H,3-4H2,1-2H3
• InChIKey: HJJATBGEIYVWQF-UHFFFAOYSA-N
• XLogP: 11.36
• TPSA: 427.68 Ų
• H-Bond Donors: 16
• H-Bond Acceptors: 30
• Rotatable Bonds: 28
• Heavy Atoms: 146
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2103.25
LogP ≤ 5	11.36
H-Bond Donors ≤ 5	16
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1-propan-2-ylpyrrolidin-3-amine;2-(propan-2-ylamino)ethanol;2-[2-(propan-2-ylamino)ethylamino]ethanol;3-propan-2-ylazetidine;(1-propan-2-ylazetidin-3-yl) dihydrogen phosphate;(1-propan-2-ylazetidin-3-yl)methanamine;(1-propan-2-ylazetidin-3-yl)methanol;2-(1-propan-2-ylazetidin-3-yl)oxypyridine;propan-2-ylcyclopentane;1-propan-2-ylpiperidin-3-amine;1-propan-2-ylpiperidin-4-amine;1-propan-2-ylpiperidine-4-carbonitrile;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpiperidin-4-ol;1-propan-2-ylpyrrolidin-3-amine?

The IUPAC name of 4-fluoro-1-propan-2-ylpyrrolidin-3-amine;2-(propan-2-ylamino)ethanol;2-[2-(propan-2-ylamino)ethylamino]ethanol;3-propan-2-ylazetidine;(1-propan-2-ylazetidin-3-yl) dihydrogen phosphate;(1-propan-2-ylazetidin-3-yl)methanamine;(1-propan-2-ylazetidin-3-yl)methanol;2-(1-propan-2-ylazetidin-3-yl)oxypyridine;propan-2-ylcyclopentane;1-propan-2-ylpiperidin-3-amine;1-propan-2-ylpiperidin-4-amine;1-propan-2-ylpiperidine-4-carbonitrile;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpiperidin-4-ol;1-propan-2-ylpyrrolidin-3-amine (CID 158496547) is 4-fluoro-1-propan-2-ylpyrrolidin-3-amine;2-(propan-2-ylamino)ethanol;2-[2-(propan-2-ylamino)ethylamino]ethanol;3-propan-2-ylazetidine;(1-propan-2-ylazetidin-3-yl) dihydrogen phosphate;(1-propan-2-ylazetidin-3-yl)methanamine;(1-propan-2-ylazetidin-3-yl)methanol;2-(1-propan-2-ylazetidin-3-yl)oxypyridine;propan-2-ylcyclopentane;1-propan-2-ylpiperidin-3-amine;1-propan-2-ylpiperidin-4-amine;1-propan-2-ylpiperidine-4-carbonitrile;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpiperidin-4-ol;1-propan-2-ylpyrrolidin-3-amine.

What is the SMILES notation for 4-fluoro-1-propan-2-ylpyrrolidin-3-amine;2-(propan-2-ylamino)ethanol;2-[2-(propan-2-ylamino)ethylamino]ethanol;3-propan-2-ylazetidine;(1-propan-2-ylazetidin-3-yl) dihydrogen phosphate;(1-propan-2-ylazetidin-3-yl)methanamine;(1-propan-2-ylazetidin-3-yl)methanol;2-(1-propan-2-ylazetidin-3-yl)oxypyridine;propan-2-ylcyclopentane;1-propan-2-ylpiperidin-3-amine;1-propan-2-ylpiperidin-4-amine;1-propan-2-ylpiperidine-4-carbonitrile;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpiperidin-4-ol;1-propan-2-ylpyrrolidin-3-amine?

The canonical SMILES for 4-fluoro-1-propan-2-ylpyrrolidin-3-amine;2-(propan-2-ylamino)ethanol;2-[2-(propan-2-ylamino)ethylamino]ethanol;3-propan-2-ylazetidine;(1-propan-2-ylazetidin-3-yl) dihydrogen phosphate;(1-propan-2-ylazetidin-3-yl)methanamine;(1-propan-2-ylazetidin-3-yl)methanol;2-(1-propan-2-ylazetidin-3-yl)oxypyridine;propan-2-ylcyclopentane;1-propan-2-ylpiperidin-3-amine;1-propan-2-ylpiperidin-4-amine;1-propan-2-ylpiperidine-4-carbonitrile;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpiperidin-4-ol;1-propan-2-ylpyrrolidin-3-amine is CC(C)C1CCCC1.CC(C)C1CNC1.CC(C)N1CC(CN)C1.CC(C)N1CC(CO)C1.CC(C)N1CC(N)C(F)C1.CC(C)N1CC(OP(=O)(O)O)C1.CC(C)N1CC(Oc2ccccn2)C1.CC(C)N1CCC(C#N)CC1.CC(C)N1CCC(N)C1.CC(C)N1CCC(N)CC1.CC(C)N1CCC(O)CC1.CC(C)N1CCCC(N)C1.CC(C)N1CCCC(O)C1.CC(C)NCCNCCO.CC(C)NCCO.

What is the InChIKey of 4-fluoro-1-propan-2-ylpyrrolidin-3-amine;2-(propan-2-ylamino)ethanol;2-[2-(propan-2-ylamino)ethylamino]ethanol;3-propan-2-ylazetidine;(1-propan-2-ylazetidin-3-yl) dihydrogen phosphate;(1-propan-2-ylazetidin-3-yl)methanamine;(1-propan-2-ylazetidin-3-yl)methanol;2-(1-propan-2-ylazetidin-3-yl)oxypyridine;propan-2-ylcyclopentane;1-propan-2-ylpiperidin-3-amine;1-propan-2-ylpiperidin-4-amine;1-propan-2-ylpiperidine-4-carbonitrile;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpiperidin-4-ol;1-propan-2-ylpyrrolidin-3-amine?

The InChIKey is HJJATBGEIYVWQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O.C9H16N2.2C8H18N2.2C8H17NO.C8H16.C7H15FN2.C7H18N2O.2C7H16N2.C7H15NO.C6H14NO4P.C6H13N.C5H13NO/c1-9(2)13-7-10(8-13)14-11-5-3-4-6-12-11;1-8(2)11-5-3-9(7-10)4-6-11;1-7(2)10-5-3-8(9)4-6-10;1-7(2)10-5-3-4-8(9)6-10;1-7(2)9-5-3-8(10)4-6-9;1-7(2)9-5-3-4-8(10)6-9;1-7(2)8-5-3-4-6-8;1-5(2)10-3-6(8)7(9)4-10;1-7(2)9-4-3-8-5-6-10;1-6(2)9-4-7(3-8)5-9;1-6(2)9-4-3-7(8)5-9;1-6(2)8-3-7(4-8)5-9;1-5(2)7-3-6(4-7)11-12(8,9)10;1-5(2)6-3-7-4-6;1-5(2)6-3-4-7/h3-6,9-10H,7-8H2,1-2H3;8-9H,3-6H2,1-2H3;2*7-8H,3-6,9H2,1-2H3;2*7-8,10H,3-6H2,1-2H3;7-8H,3-6H2,1-2H3;5-7H,3-4,9H2,1-2H3;7-10H,3-6H2,1-2H3;2*6-7H,3-5,8H2,1-2H3;6-7,9H,3-5H2,1-2H3;5-6H,3-4H2,1-2H3,(H2,8,9,10);2*5-7H,3-4H2,1-2H3.

What are the key properties of 4-fluoro-1-propan-2-ylpyrrolidin-3-amine;2-(propan-2-ylamino)ethanol;2-[2-(propan-2-ylamino)ethylamino]ethanol;3-propan-2-ylazetidine;(1-propan-2-ylazetidin-3-yl) dihydrogen phosphate;(1-propan-2-ylazetidin-3-yl)methanamine;(1-propan-2-ylazetidin-3-yl)methanol;2-(1-propan-2-ylazetidin-3-yl)oxypyridine;propan-2-ylcyclopentane;1-propan-2-ylpiperidin-3-amine;1-propan-2-ylpiperidin-4-amine;1-propan-2-ylpiperidine-4-carbonitrile;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpiperidin-4-ol;1-propan-2-ylpyrrolidin-3-amine?

4-fluoro-1-propan-2-ylpyrrolidin-3-amine;2-(propan-2-ylamino)ethanol;2-[2-(propan-2-ylamino)ethylamino]ethanol;3-propan-2-ylazetidine;(1-propan-2-ylazetidin-3-yl) dihydrogen phosphate;(1-propan-2-ylazetidin-3-yl)methanamine;(1-propan-2-ylazetidin-3-yl)methanol;2-(1-propan-2-ylazetidin-3-yl)oxypyridine;propan-2-ylcyclopentane;1-propan-2-ylpiperidin-3-amine;1-propan-2-ylpiperidin-4-amine;1-propan-2-ylpiperidine-4-carbonitrile;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpiperidin-4-ol;1-propan-2-ylpyrrolidin-3-amine has a molecular weight of 2103.25 g/mol, XLogP of 11.36, 28 rotatable bonds, 16 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 4-fluoro-1-propan-2-ylpyrrolidin-3-amine;2-(propan-2-ylamino)ethanol;2-[2-(propan-2-ylamino)ethylamino]ethanol;3-propan-2-ylazetidine;(1-propan-2-ylazetidin-3-yl) dihydrogen phosphate;(1-propan-2-ylazetidin-3-yl)methanamine;(1-propan-2-ylazetidin-3-yl)methanol;2-(1-propan-2-ylazetidin-3-yl)oxypyridine;propan-2-ylcyclopentane;1-propan-2-ylpiperidin-3-amine;1-propan-2-ylpiperidin-4-amine;1-propan-2-ylpiperidine-4-carbonitrile;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpiperidin-4-ol;1-propan-2-ylpyrrolidin-3-amine is sourced from PubChem (CID 158496547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).