(1S,4R)-4-tert-butylcyclopent-2-en-1-ol;(1R,4R)-4-tert-butylcyclopent-2-en-1-ol;4-tert-butylcyclopent-2-en-1-ol;4-tert-butyl-1-ethylpiperidine;4-tert-butyloxane;4-tert-butylpiperidine;1-(4-tert-butylpiperidin-1-yl)ethanone;2-(2,2-dimethylpropyl)pyridine;3-(2,2-dimethylpropyl)pyridine;4-(2,2-dimethylpropyl)pyridine;2,2,3,3-tetramethylbutanenitrile;2,2,3,3-tetramethylpentane;(2R)-2,3,3-trimethylbutanenitrile;2,3,3-trimethylbutanenitrile;2,4,4-trimethylpentan-2-ol

C136H253N9O6 — CID 161118699

About (1S,4R)-4-tert-butylcyclopent-2-en-1-ol;(1R,4R)-4-tert-butylcyclopent-2-en-1-ol;4-tert-butylcyclopent-2-en-1-ol;4-tert-butyl-1-ethylpiperidine;4-tert-butyloxane;4-tert-butylpiperidine;1-(4-tert-butylpiperidin-1-yl)ethanone;2-(2,2-dimethylpropyl)pyridine;3-(2,2-dimethylpropyl)pyridine;4-(2,2-dimethylpropyl)pyridine;2,2,3,3-tetramethylbutanenitrile;2,2,3,3-tetramethylpentane;(2R)-2,3,3-trimethylbutanenitrile;2,3,3-trimethylbutanenitrile;2,4,4-trimethylpentan-2-ol

(1S,4R)-4-tert-butylcyclopent-2-en-1-ol;(1R,4R)-4-tert-butylcyclopent-2-en-1-ol;4-tert-butylcyclopent-2-en-1-ol;4-tert-butyl-1-ethylpiperidine;4-tert-butyloxane;4-tert-butylpiperidine;1-(4-tert-butylpiperidin-1-yl)ethanone;2-(2,2-dimethylpropyl)pyridine;3-(2,2-dimethylpropyl)pyridine;4-(2,2-dimethylpropyl)pyridine;2,2,3,3-tetramethylbutanenitrile;2,2,3,3-tetramethylpentane;(2R)-2,3,3-trimethylbutanenitrile;2,3,3-trimethylbutanenitrile;2,4,4-trimethylpentan-2-ol (PubChem CID 161118699) has the molecular formula C136H253N9O6 and a molecular weight of 2110.58 g/mol. Its IUPAC name is (1S,4R)-4-tert-butylcyclopent-2-en-1-ol;(1R,4R)-4-tert-butylcyclopent-2-en-1-ol;4-tert-butylcyclopent-2-en-1-ol;4-tert-butyl-1-ethylpiperidine;4-tert-butyloxane;4-tert-butylpiperidine;1-(4-tert-butylpiperidin-1-yl)ethanone;2-(2,2-dimethylpropyl)pyridine;3-(2,2-dimethylpropyl)pyridine;4-(2,2-dimethylpropyl)pyridine;2,2,3,3-tetramethylbutanenitrile;2,2,3,3-tetramethylpentane;(2R)-2,3,3-trimethylbutanenitrile;2,3,3-trimethylbutanenitrile;2,4,4-trimethylpentan-2-ol.

Molecular Properties

• Compound Name: (1S,4R)-4-tert-butylcyclopent-2-en-1-ol;(1R,4R)-4-tert-butylcyclopent-2-en-1-ol;4-tert-butylcyclopent-2-en-1-ol;4-tert-butyl-1-ethylpiperidine;4-tert-butyloxane;4-tert-butylpiperidine;1-(4-tert-butylpiperidin-1-yl)ethanone;2-(2,2-dimethylpropyl)pyridine;3-(2,2-dimethylpropyl)pyridine;4-(2,2-dimethylpropyl)pyridine;2,2,3,3-tetramethylbutanenitrile;2,2,3,3-tetramethylpentane;(2R)-2,3,3-trimethylbutanenitrile;2,3,3-trimethylbutanenitrile;2,4,4-trimethylpentan-2-ol
• PubChem CID: 161118699
• Molecular Formula: C136H253N9O6
• Molecular Weight: 2110.58 g/mol
• Exact Mass: 2108.98
• IUPAC Name: (1S,4R)-4-tert-butylcyclopent-2-en-1-ol;(1R,4R)-4-tert-butylcyclopent-2-en-1-ol;4-tert-butylcyclopent-2-en-1-ol;4-tert-butyl-1-ethylpiperidine;4-tert-butyloxane;4-tert-butylpiperidine;1-(4-tert-butylpiperidin-1-yl)ethanone;2-(2,2-dimethylpropyl)pyridine;3-(2,2-dimethylpropyl)pyridine;4-(2,2-dimethylpropyl)pyridine;2,2,3,3-tetramethylbutanenitrile;2,2,3,3-tetramethylpentane;(2R)-2,3,3-trimethylbutanenitrile;2,3,3-trimethylbutanenitrile;2,4,4-trimethylpentan-2-ol
• SMILES: CC(=O)N1CCC(C(C)(C)C)CC1.CC(C#N)C(C)(C)C.CC(C)(C)C(C)(C)C#N.CC(C)(C)C1C=CC(O)C1.CC(C)(C)C1CCNCC1.CC(C)(C)C1CCOCC1.CC(C)(C)CC(C)(C)O.CC(C)(C)Cc1ccccn1.CC(C)(C)Cc1cccnc1.CC(C)(C)Cc1ccncc1.CC(C)(C)[C@H]1C=C[C@@H](O)C1.CC(C)(C)[C@H]1C=C[C@H](O)C1.CCC(C)(C)C(C)(C)C.CCN1CCC(C(C)(C)C)CC1.C[C@@H](C#N)C(C)(C)C
• InChI: InChI=1S/C11H21NO.C11H23N.3C10H15N.C9H19N.C9H18O.3C9H16O.C9H20.C8H15N.C8H18O.2C7H13N/c1-9(13)12-7-5-10(6-8-12)11(2,3)4;1-5-12-8-6-10(7-9-12)11(2,3)4;1-10(2,3)8-9-4-6-11-7-5-9;1-10(2,3)7-9-5-4-6-11-8-9;1-10(2,3)8-9-6-4-5-7-11-9;2*1-9(2,3)8-4-6-10-7-5-8;3*1-9(2,3)7-4-5-8(10)6-7;1-7-9(5,6)8(2,3)4;1-7(2,3)8(4,5)6-9;1-7(2,3)6-8(4,5)9;2*1-6(5-8)7(2,3)4/h10H,5-8H2,1-4H3;10H,5-9H2,1-4H3;4-7H,8H2,1-3H3;4-6,8H,7H2,1-3H3;4-7H,8H2,1-3H3;8,10H,4-7H2,1-3H3;8H,4-7H2,1-3H3;3*4-5,7-8,10H,6H2,1-3H3;7H2,1-6H3;1-5H3;9H,6H2,1-5H3;2*6H,1-4H3/t;;;;;;;7-,8+;7-,8-;;;;;6-;/m.......00....0./s1
• InChIKey: UKQVVUWCTTYPOF-AJOPVFPRSA-N
• XLogP: 36.09
• TPSA: 235.77 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 14
• Rotatable Bonds: 6
• Heavy Atoms: 151
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2110.58
LogP ≤ 5	36.09
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (1S,4R)-4-tert-butylcyclopent-2-en-1-ol;(1R,4R)-4-tert-butylcyclopent-2-en-1-ol;4-tert-butylcyclopent-2-en-1-ol;4-tert-butyl-1-ethylpiperidine;4-tert-butyloxane;4-tert-butylpiperidine;1-(4-tert-butylpiperidin-1-yl)ethanone;2-(2,2-dimethylpropyl)pyridine;3-(2,2-dimethylpropyl)pyridine;4-(2,2-dimethylpropyl)pyridine;2,2,3,3-tetramethylbutanenitrile;2,2,3,3-tetramethylpentane;(2R)-2,3,3-trimethylbutanenitrile;2,3,3-trimethylbutanenitrile;2,4,4-trimethylpentan-2-ol?

The IUPAC name of (1S,4R)-4-tert-butylcyclopent-2-en-1-ol;(1R,4R)-4-tert-butylcyclopent-2-en-1-ol;4-tert-butylcyclopent-2-en-1-ol;4-tert-butyl-1-ethylpiperidine;4-tert-butyloxane;4-tert-butylpiperidine;1-(4-tert-butylpiperidin-1-yl)ethanone;2-(2,2-dimethylpropyl)pyridine;3-(2,2-dimethylpropyl)pyridine;4-(2,2-dimethylpropyl)pyridine;2,2,3,3-tetramethylbutanenitrile;2,2,3,3-tetramethylpentane;(2R)-2,3,3-trimethylbutanenitrile;2,3,3-trimethylbutanenitrile;2,4,4-trimethylpentan-2-ol (CID 161118699) is (1S,4R)-4-tert-butylcyclopent-2-en-1-ol;(1R,4R)-4-tert-butylcyclopent-2-en-1-ol;4-tert-butylcyclopent-2-en-1-ol;4-tert-butyl-1-ethylpiperidine;4-tert-butyloxane;4-tert-butylpiperidine;1-(4-tert-butylpiperidin-1-yl)ethanone;2-(2,2-dimethylpropyl)pyridine;3-(2,2-dimethylpropyl)pyridine;4-(2,2-dimethylpropyl)pyridine;2,2,3,3-tetramethylbutanenitrile;2,2,3,3-tetramethylpentane;(2R)-2,3,3-trimethylbutanenitrile;2,3,3-trimethylbutanenitrile;2,4,4-trimethylpentan-2-ol.

What is the SMILES notation for (1S,4R)-4-tert-butylcyclopent-2-en-1-ol;(1R,4R)-4-tert-butylcyclopent-2-en-1-ol;4-tert-butylcyclopent-2-en-1-ol;4-tert-butyl-1-ethylpiperidine;4-tert-butyloxane;4-tert-butylpiperidine;1-(4-tert-butylpiperidin-1-yl)ethanone;2-(2,2-dimethylpropyl)pyridine;3-(2,2-dimethylpropyl)pyridine;4-(2,2-dimethylpropyl)pyridine;2,2,3,3-tetramethylbutanenitrile;2,2,3,3-tetramethylpentane;(2R)-2,3,3-trimethylbutanenitrile;2,3,3-trimethylbutanenitrile;2,4,4-trimethylpentan-2-ol?

The canonical SMILES for (1S,4R)-4-tert-butylcyclopent-2-en-1-ol;(1R,4R)-4-tert-butylcyclopent-2-en-1-ol;4-tert-butylcyclopent-2-en-1-ol;4-tert-butyl-1-ethylpiperidine;4-tert-butyloxane;4-tert-butylpiperidine;1-(4-tert-butylpiperidin-1-yl)ethanone;2-(2,2-dimethylpropyl)pyridine;3-(2,2-dimethylpropyl)pyridine;4-(2,2-dimethylpropyl)pyridine;2,2,3,3-tetramethylbutanenitrile;2,2,3,3-tetramethylpentane;(2R)-2,3,3-trimethylbutanenitrile;2,3,3-trimethylbutanenitrile;2,4,4-trimethylpentan-2-ol is CC(=O)N1CCC(C(C)(C)C)CC1.CC(C#N)C(C)(C)C.CC(C)(C)C(C)(C)C#N.CC(C)(C)C1C=CC(O)C1.CC(C)(C)C1CCNCC1.CC(C)(C)C1CCOCC1.CC(C)(C)CC(C)(C)O.CC(C)(C)Cc1ccccn1.CC(C)(C)Cc1cccnc1.CC(C)(C)Cc1ccncc1.CC(C)(C)[C@H]1C=C[C@@H](O)C1.CC(C)(C)[C@H]1C=C[C@H](O)C1.CCC(C)(C)C(C)(C)C.CCN1CCC(C(C)(C)C)CC1.C[C@@H](C#N)C(C)(C)C.

What is the InChIKey of (1S,4R)-4-tert-butylcyclopent-2-en-1-ol;(1R,4R)-4-tert-butylcyclopent-2-en-1-ol;4-tert-butylcyclopent-2-en-1-ol;4-tert-butyl-1-ethylpiperidine;4-tert-butyloxane;4-tert-butylpiperidine;1-(4-tert-butylpiperidin-1-yl)ethanone;2-(2,2-dimethylpropyl)pyridine;3-(2,2-dimethylpropyl)pyridine;4-(2,2-dimethylpropyl)pyridine;2,2,3,3-tetramethylbutanenitrile;2,2,3,3-tetramethylpentane;(2R)-2,3,3-trimethylbutanenitrile;2,3,3-trimethylbutanenitrile;2,4,4-trimethylpentan-2-ol?

The InChIKey is UKQVVUWCTTYPOF-AJOPVFPRSA-N. The full InChI is InChI=1S/C11H21NO.C11H23N.3C10H15N.C9H19N.C9H18O.3C9H16O.C9H20.C8H15N.C8H18O.2C7H13N/c1-9(13)12-7-5-10(6-8-12)11(2,3)4;1-5-12-8-6-10(7-9-12)11(2,3)4;1-10(2,3)8-9-4-6-11-7-5-9;1-10(2,3)7-9-5-4-6-11-8-9;1-10(2,3)8-9-6-4-5-7-11-9;2*1-9(2,3)8-4-6-10-7-5-8;3*1-9(2,3)7-4-5-8(10)6-7;1-7-9(5,6)8(2,3)4;1-7(2,3)8(4,5)6-9;1-7(2,3)6-8(4,5)9;2*1-6(5-8)7(2,3)4/h10H,5-8H2,1-4H3;10H,5-9H2,1-4H3;4-7H,8H2,1-3H3;4-6,8H,7H2,1-3H3;4-7H,8H2,1-3H3;8,10H,4-7H2,1-3H3;8H,4-7H2,1-3H3;3*4-5,7-8,10H,6H2,1-3H3;7H2,1-6H3;1-5H3;9H,6H2,1-5H3;2*6H,1-4H3/t;;;;;;;7-,8+;7-,8-;;;;;6-;/m.......00....0./s1.

What are the key properties of (1S,4R)-4-tert-butylcyclopent-2-en-1-ol;(1R,4R)-4-tert-butylcyclopent-2-en-1-ol;4-tert-butylcyclopent-2-en-1-ol;4-tert-butyl-1-ethylpiperidine;4-tert-butyloxane;4-tert-butylpiperidine;1-(4-tert-butylpiperidin-1-yl)ethanone;2-(2,2-dimethylpropyl)pyridine;3-(2,2-dimethylpropyl)pyridine;4-(2,2-dimethylpropyl)pyridine;2,2,3,3-tetramethylbutanenitrile;2,2,3,3-tetramethylpentane;(2R)-2,3,3-trimethylbutanenitrile;2,3,3-trimethylbutanenitrile;2,4,4-trimethylpentan-2-ol?

(1S,4R)-4-tert-butylcyclopent-2-en-1-ol;(1R,4R)-4-tert-butylcyclopent-2-en-1-ol;4-tert-butylcyclopent-2-en-1-ol;4-tert-butyl-1-ethylpiperidine;4-tert-butyloxane;4-tert-butylpiperidine;1-(4-tert-butylpiperidin-1-yl)ethanone;2-(2,2-dimethylpropyl)pyridine;3-(2,2-dimethylpropyl)pyridine;4-(2,2-dimethylpropyl)pyridine;2,2,3,3-tetramethylbutanenitrile;2,2,3,3-tetramethylpentane;(2R)-2,3,3-trimethylbutanenitrile;2,3,3-trimethylbutanenitrile;2,4,4-trimethylpentan-2-ol has a molecular weight of 2110.58 g/mol, XLogP of 36.09, 6 rotatable bonds, 5 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for (1S,4R)-4-tert-butylcyclopent-2-en-1-ol;(1R,4R)-4-tert-butylcyclopent-2-en-1-ol;4-tert-butylcyclopent-2-en-1-ol;4-tert-butyl-1-ethylpiperidine;4-tert-butyloxane;4-tert-butylpiperidine;1-(4-tert-butylpiperidin-1-yl)ethanone;2-(2,2-dimethylpropyl)pyridine;3-(2,2-dimethylpropyl)pyridine;4-(2,2-dimethylpropyl)pyridine;2,2,3,3-tetramethylbutanenitrile;2,2,3,3-tetramethylpentane;(2R)-2,3,3-trimethylbutanenitrile;2,3,3-trimethylbutanenitrile;2,4,4-trimethylpentan-2-ol is sourced from PubChem (CID 161118699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).