1-cyclopropyl-5,5-dimethylhexan-2-one;(E)-1-cyclopropyl-5,5-dimethylhex-3-en-2-one;1-(6,7-dimethoxyquinazolin-4-yl)pentan-2-one;5,5-dimethylhexan-1-ol;2-(5,5-dimethylhexoxymethyl)pyridine;N-(5,5-dimethylhexyl)pyridin-2-amine;4,4-dimethyl-1-morpholin-4-ylpentan-1-one;4,4-dimethylpentanoic acid;4,4-dimethylpentan-1-ol;7-(2,2-dimethylpropyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine;4,4-dimethyl-1-pyrrolidin-1-ylpentan-1-one;(E)-4,4-dimethyl-1-pyrrolidin-1-ylpent-2-en-1-one;ethyl 4,4-dimethylpentanoate;1-(1H-indazol-5-yl)-5,5-dimethylhexan-2-one;1-(3H-isoindol-5-yl)-5,5-dimethylhexan-2-one;2-methoxy-2,5,5-trimethylhex-3-yne;2,2,5,5-tetramethylhex-3-yne;1,1,1-trideuterio-2,5,5-trimethylhex-3-yn-2-ol;2,5,5-trimethylhex-1-en-3-yne;2,5,5-trimethylhex-3-yn-2-ol

C216H369N15O21 — CID 158344914

About 1-cyclopropyl-5,5-dimethylhexan-2-one;(E)-1-cyclopropyl-5,5-dimethylhex-3-en-2-one;1-(6,7-dimethoxyquinazolin-4-yl)pentan-2-one;5,5-dimethylhexan-1-ol;2-(5,5-dimethylhexoxymethyl)pyridine;N-(5,5-dimethylhexyl)pyridin-2-amine;4,4-dimethyl-1-morpholin-4-ylpentan-1-one;4,4-dimethylpentanoic acid;4,4-dimethylpentan-1-ol;7-(2,2-dimethylpropyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine;4,4-dimethyl-1-pyrrolidin-1-ylpentan-1-one;(E)-4,4-dimethyl-1-pyrrolidin-1-ylpent-2-en-1-one;ethyl 4,4-dimethylpentanoate;1-(1H-indazol-5-yl)-5,5-dimethylhexan-2-one;1-(3H-isoindol-5-yl)-5,5-dimethylhexan-2-one;2-methoxy-2,5,5-trimethylhex-3-yne;2,2,5,5-tetramethylhex-3-yne;1,1,1-trideuterio-2,5,5-trimethylhex-3-yn-2-ol;2,5,5-trimethylhex-1-en-3-yne;2,5,5-trimethylhex-3-yn-2-ol

1-cyclopropyl-5,5-dimethylhexan-2-one;(E)-1-cyclopropyl-5,5-dimethylhex-3-en-2-one;1-(6,7-dimethoxyquinazolin-4-yl)pentan-2-one;5,5-dimethylhexan-1-ol;2-(5,5-dimethylhexoxymethyl)pyridine;N-(5,5-dimethylhexyl)pyridin-2-amine;4,4-dimethyl-1-morpholin-4-ylpentan-1-one;4,4-dimethylpentanoic acid;4,4-dimethylpentan-1-ol;7-(2,2-dimethylpropyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine;4,4-dimethyl-1-pyrrolidin-1-ylpentan-1-one;(E)-4,4-dimethyl-1-pyrrolidin-1-ylpent-2-en-1-one;ethyl 4,4-dimethylpentanoate;1-(1H-indazol-5-yl)-5,5-dimethylhexan-2-one;1-(3H-isoindol-5-yl)-5,5-dimethylhexan-2-one;2-methoxy-2,5,5-trimethylhex-3-yne;2,2,5,5-tetramethylhex-3-yne;1,1,1-trideuterio-2,5,5-trimethylhex-3-yn-2-ol;2,5,5-trimethylhex-1-en-3-yne;2,5,5-trimethylhex-3-yn-2-ol (PubChem CID 158344914) has the molecular formula C216H369N15O21 and a molecular weight of 3515.43 g/mol. Its IUPAC name is 1-cyclopropyl-5,5-dimethylhexan-2-one;(E)-1-cyclopropyl-5,5-dimethylhex-3-en-2-one;1-(6,7-dimethoxyquinazolin-4-yl)pentan-2-one;5,5-dimethylhexan-1-ol;2-(5,5-dimethylhexoxymethyl)pyridine;N-(5,5-dimethylhexyl)pyridin-2-amine;4,4-dimethyl-1-morpholin-4-ylpentan-1-one;4,4-dimethylpentanoic acid;4,4-dimethylpentan-1-ol;7-(2,2-dimethylpropyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine;4,4-dimethyl-1-pyrrolidin-1-ylpentan-1-one;(E)-4,4-dimethyl-1-pyrrolidin-1-ylpent-2-en-1-one;ethyl 4,4-dimethylpentanoate;1-(1H-indazol-5-yl)-5,5-dimethylhexan-2-one;1-(3H-isoindol-5-yl)-5,5-dimethylhexan-2-one;2-methoxy-2,5,5-trimethylhex-3-yne;2,2,5,5-tetramethylhex-3-yne;1,1,1-trideuterio-2,5,5-trimethylhex-3-yn-2-ol;2,5,5-trimethylhex-1-en-3-yne;2,5,5-trimethylhex-3-yn-2-ol.

Molecular Properties

• Compound Name: 1-cyclopropyl-5,5-dimethylhexan-2-one;(E)-1-cyclopropyl-5,5-dimethylhex-3-en-2-one;1-(6,7-dimethoxyquinazolin-4-yl)pentan-2-one;5,5-dimethylhexan-1-ol;2-(5,5-dimethylhexoxymethyl)pyridine;N-(5,5-dimethylhexyl)pyridin-2-amine;4,4-dimethyl-1-morpholin-4-ylpentan-1-one;4,4-dimethylpentanoic acid;4,4-dimethylpentan-1-ol;7-(2,2-dimethylpropyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine;4,4-dimethyl-1-pyrrolidin-1-ylpentan-1-one;(E)-4,4-dimethyl-1-pyrrolidin-1-ylpent-2-en-1-one;ethyl 4,4-dimethylpentanoate;1-(1H-indazol-5-yl)-5,5-dimethylhexan-2-one;1-(3H-isoindol-5-yl)-5,5-dimethylhexan-2-one;2-methoxy-2,5,5-trimethylhex-3-yne;2,2,5,5-tetramethylhex-3-yne;1,1,1-trideuterio-2,5,5-trimethylhex-3-yn-2-ol;2,5,5-trimethylhex-1-en-3-yne;2,5,5-trimethylhex-3-yn-2-ol
• PubChem CID: 158344914
• Molecular Formula: C216H369N15O21
• Molecular Weight: 3515.43 g/mol
• Exact Mass: 3512.85
• IUPAC Name: 1-cyclopropyl-5,5-dimethylhexan-2-one;(E)-1-cyclopropyl-5,5-dimethylhex-3-en-2-one;1-(6,7-dimethoxyquinazolin-4-yl)pentan-2-one;5,5-dimethylhexan-1-ol;2-(5,5-dimethylhexoxymethyl)pyridine;N-(5,5-dimethylhexyl)pyridin-2-amine;4,4-dimethyl-1-morpholin-4-ylpentan-1-one;4,4-dimethylpentanoic acid;4,4-dimethylpentan-1-ol;7-(2,2-dimethylpropyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine;4,4-dimethyl-1-pyrrolidin-1-ylpentan-1-one;(E)-4,4-dimethyl-1-pyrrolidin-1-ylpent-2-en-1-one;ethyl 4,4-dimethylpentanoate;1-(1H-indazol-5-yl)-5,5-dimethylhexan-2-one;1-(3H-isoindol-5-yl)-5,5-dimethylhexan-2-one;2-methoxy-2,5,5-trimethylhex-3-yne;2,2,5,5-tetramethylhex-3-yne;1,1,1-trideuterio-2,5,5-trimethylhex-3-yn-2-ol;2,5,5-trimethylhex-1-en-3-yne;2,5,5-trimethylhex-3-yn-2-ol
• SMILES: C=C(C)C#CC(C)(C)C.CC(C)(C)/C=C/C(=O)CC1CC1.CC(C)(C)/C=C/C(=O)N1CCCC1.CC(C)(C)C#CC(C)(C)C.CC(C)(C)C#CC(C)(C)O.CC(C)(C)CCC(=O)CC1CC1.CC(C)(C)CCC(=O)Cc1ccc2[nH]ncc2c1.CC(C)(C)CCC(=O)Cc1ccc2c(c1)CN=C2.CC(C)(C)CCC(=O)N1CCCC1.CC(C)(C)CCC(=O)N1CCOCC1.CC(C)(C)CCC(=O)O.CC(C)(C)CCCCNc1ccccn1.CC(C)(C)CCCCO.CC(C)(C)CCCCOCc1ccccn1.CC(C)(C)CCCO.CC(C)(C)CN1CCn2ncnc2C1.CCCC(=O)Cc1ncnc2cc(OC)c(OC)cc12.CCOC(=O)CCC(C)(C)C.COC(C)(C)C#CC(C)(C)C.[2H]C([2H])([2H])C(C)(O)C#CC(C)(C)C
• InChI: InChI=1S/C16H21NO.C15H18N2O3.C15H20N2O.C14H23NO.C13H22N2.C11H21NO2.C11H21NO.C11H19NO.C11H20O.C11H18O.C10H18N4.C10H18O.C10H18.C9H18O2.2C9H16O.C9H14.C8H18O.C7H14O2.C7H16O/c1-16(2,3)7-6-15(18)9-12-4-5-13-10-17-11-14(13)8-12;1-4-5-10(18)6-12-11-7-14(19-2)15(20-3)8-13(11)17-9-16-12;1-15(2,3)7-6-13(18)9-11-4-5-14-12(8-11)10-16-17-14;1-14(2,3)9-5-7-11-16-12-13-8-4-6-10-15-13;1-13(2,3)9-5-7-11-15-12-8-4-6-10-14-12;1-11(2,3)5-4-10(13)12-6-8-14-9-7-12;2*1-11(2,3)7-6-10(13)12-8-4-5-9-12;2*1-11(2,3)7-6-10(12)8-9-4-5-9;1-10(2,3)7-13-4-5-14-9(6-13)11-8-12-14;1-9(2,3)7-8-10(4,5)11-6;1-9(2,3)7-8-10(4,5)6;1-5-11-8(10)6-7-9(2,3)4;2*1-8(2,3)6-7-9(4,5)10;1-8(2)6-7-9(3,4)5;1-8(2,3)6-4-5-7-9;1-7(2,3)5-4-6(8)9;1-7(2,3)5-4-6-8/h4-5,8,10H,6-7,9,11H2,1-3H3;7-9H,4-6H2,1-3H3;4-5,8,10H,6-7,9H2,1-3H3,(H,16,17);4,6,8,10H,5,7,9,11-12H2,1-3H3;4,6,8,10H,5,7,9,11H2,1-3H3,(H,14,15);4-9H2,1-3H3;4-9H2,1-3H3;6-7H,4-5,8-9H2,1-3H3;9H,4-8H2,1-3H3;6-7,9H,4-5,8H2,1-3H3;8H,4-7H2,1-3H3;1-6H3;1-6H3;5-7H2,1-4H3;2*10H,1-5H3;1H2,2-5H3;9H,4-7H2,1-3H3;4-5H2,1-3H3,(H,8,9);8H,4-6H2,1-3H3/b;;;;;;;7-6+;;7-6+;;;;;;;;;;/i;;;;;;;;;;;;;;4D3
• InChIKey: GRPODSOJRNUDGK-HEBHVIIVSA-N
• XLogP: 50.78
• TPSA: 475.53 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 31
• Rotatable Bonds: 50
• Heavy Atoms: 252
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3515.43
LogP ≤ 5	50.78
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-5,5-dimethylhexan-2-one;(E)-1-cyclopropyl-5,5-dimethylhex-3-en-2-one;1-(6,7-dimethoxyquinazolin-4-yl)pentan-2-one;5,5-dimethylhexan-1-ol;2-(5,5-dimethylhexoxymethyl)pyridine;N-(5,5-dimethylhexyl)pyridin-2-amine;4,4-dimethyl-1-morpholin-4-ylpentan-1-one;4,4-dimethylpentanoic acid;4,4-dimethylpentan-1-ol;7-(2,2-dimethylpropyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine;4,4-dimethyl-1-pyrrolidin-1-ylpentan-1-one;(E)-4,4-dimethyl-1-pyrrolidin-1-ylpent-2-en-1-one;ethyl 4,4-dimethylpentanoate;1-(1H-indazol-5-yl)-5,5-dimethylhexan-2-one;1-(3H-isoindol-5-yl)-5,5-dimethylhexan-2-one;2-methoxy-2,5,5-trimethylhex-3-yne;2,2,5,5-tetramethylhex-3-yne;1,1,1-trideuterio-2,5,5-trimethylhex-3-yn-2-ol;2,5,5-trimethylhex-1-en-3-yne;2,5,5-trimethylhex-3-yn-2-ol?

The IUPAC name of 1-cyclopropyl-5,5-dimethylhexan-2-one;(E)-1-cyclopropyl-5,5-dimethylhex-3-en-2-one;1-(6,7-dimethoxyquinazolin-4-yl)pentan-2-one;5,5-dimethylhexan-1-ol;2-(5,5-dimethylhexoxymethyl)pyridine;N-(5,5-dimethylhexyl)pyridin-2-amine;4,4-dimethyl-1-morpholin-4-ylpentan-1-one;4,4-dimethylpentanoic acid;4,4-dimethylpentan-1-ol;7-(2,2-dimethylpropyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine;4,4-dimethyl-1-pyrrolidin-1-ylpentan-1-one;(E)-4,4-dimethyl-1-pyrrolidin-1-ylpent-2-en-1-one;ethyl 4,4-dimethylpentanoate;1-(1H-indazol-5-yl)-5,5-dimethylhexan-2-one;1-(3H-isoindol-5-yl)-5,5-dimethylhexan-2-one;2-methoxy-2,5,5-trimethylhex-3-yne;2,2,5,5-tetramethylhex-3-yne;1,1,1-trideuterio-2,5,5-trimethylhex-3-yn-2-ol;2,5,5-trimethylhex-1-en-3-yne;2,5,5-trimethylhex-3-yn-2-ol (CID 158344914) is 1-cyclopropyl-5,5-dimethylhexan-2-one;(E)-1-cyclopropyl-5,5-dimethylhex-3-en-2-one;1-(6,7-dimethoxyquinazolin-4-yl)pentan-2-one;5,5-dimethylhexan-1-ol;2-(5,5-dimethylhexoxymethyl)pyridine;N-(5,5-dimethylhexyl)pyridin-2-amine;4,4-dimethyl-1-morpholin-4-ylpentan-1-one;4,4-dimethylpentanoic acid;4,4-dimethylpentan-1-ol;7-(2,2-dimethylpropyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine;4,4-dimethyl-1-pyrrolidin-1-ylpentan-1-one;(E)-4,4-dimethyl-1-pyrrolidin-1-ylpent-2-en-1-one;ethyl 4,4-dimethylpentanoate;1-(1H-indazol-5-yl)-5,5-dimethylhexan-2-one;1-(3H-isoindol-5-yl)-5,5-dimethylhexan-2-one;2-methoxy-2,5,5-trimethylhex-3-yne;2,2,5,5-tetramethylhex-3-yne;1,1,1-trideuterio-2,5,5-trimethylhex-3-yn-2-ol;2,5,5-trimethylhex-1-en-3-yne;2,5,5-trimethylhex-3-yn-2-ol.

What is the SMILES notation for 1-cyclopropyl-5,5-dimethylhexan-2-one;(E)-1-cyclopropyl-5,5-dimethylhex-3-en-2-one;1-(6,7-dimethoxyquinazolin-4-yl)pentan-2-one;5,5-dimethylhexan-1-ol;2-(5,5-dimethylhexoxymethyl)pyridine;N-(5,5-dimethylhexyl)pyridin-2-amine;4,4-dimethyl-1-morpholin-4-ylpentan-1-one;4,4-dimethylpentanoic acid;4,4-dimethylpentan-1-ol;7-(2,2-dimethylpropyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine;4,4-dimethyl-1-pyrrolidin-1-ylpentan-1-one;(E)-4,4-dimethyl-1-pyrrolidin-1-ylpent-2-en-1-one;ethyl 4,4-dimethylpentanoate;1-(1H-indazol-5-yl)-5,5-dimethylhexan-2-one;1-(3H-isoindol-5-yl)-5,5-dimethylhexan-2-one;2-methoxy-2,5,5-trimethylhex-3-yne;2,2,5,5-tetramethylhex-3-yne;1,1,1-trideuterio-2,5,5-trimethylhex-3-yn-2-ol;2,5,5-trimethylhex-1-en-3-yne;2,5,5-trimethylhex-3-yn-2-ol?

The canonical SMILES for 1-cyclopropyl-5,5-dimethylhexan-2-one;(E)-1-cyclopropyl-5,5-dimethylhex-3-en-2-one;1-(6,7-dimethoxyquinazolin-4-yl)pentan-2-one;5,5-dimethylhexan-1-ol;2-(5,5-dimethylhexoxymethyl)pyridine;N-(5,5-dimethylhexyl)pyridin-2-amine;4,4-dimethyl-1-morpholin-4-ylpentan-1-one;4,4-dimethylpentanoic acid;4,4-dimethylpentan-1-ol;7-(2,2-dimethylpropyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine;4,4-dimethyl-1-pyrrolidin-1-ylpentan-1-one;(E)-4,4-dimethyl-1-pyrrolidin-1-ylpent-2-en-1-one;ethyl 4,4-dimethylpentanoate;1-(1H-indazol-5-yl)-5,5-dimethylhexan-2-one;1-(3H-isoindol-5-yl)-5,5-dimethylhexan-2-one;2-methoxy-2,5,5-trimethylhex-3-yne;2,2,5,5-tetramethylhex-3-yne;1,1,1-trideuterio-2,5,5-trimethylhex-3-yn-2-ol;2,5,5-trimethylhex-1-en-3-yne;2,5,5-trimethylhex-3-yn-2-ol is C=C(C)C#CC(C)(C)C.CC(C)(C)/C=C/C(=O)CC1CC1.CC(C)(C)/C=C/C(=O)N1CCCC1.CC(C)(C)C#CC(C)(C)C.CC(C)(C)C#CC(C)(C)O.CC(C)(C)CCC(=O)CC1CC1.CC(C)(C)CCC(=O)Cc1ccc2[nH]ncc2c1.CC(C)(C)CCC(=O)Cc1ccc2c(c1)CN=C2.CC(C)(C)CCC(=O)N1CCCC1.CC(C)(C)CCC(=O)N1CCOCC1.CC(C)(C)CCC(=O)O.CC(C)(C)CCCCNc1ccccn1.CC(C)(C)CCCCO.CC(C)(C)CCCCOCc1ccccn1.CC(C)(C)CCCO.CC(C)(C)CN1CCn2ncnc2C1.CCCC(=O)Cc1ncnc2cc(OC)c(OC)cc12.CCOC(=O)CCC(C)(C)C.COC(C)(C)C#CC(C)(C)C.[2H]C([2H])([2H])C(C)(O)C#CC(C)(C)C.

What is the InChIKey of 1-cyclopropyl-5,5-dimethylhexan-2-one;(E)-1-cyclopropyl-5,5-dimethylhex-3-en-2-one;1-(6,7-dimethoxyquinazolin-4-yl)pentan-2-one;5,5-dimethylhexan-1-ol;2-(5,5-dimethylhexoxymethyl)pyridine;N-(5,5-dimethylhexyl)pyridin-2-amine;4,4-dimethyl-1-morpholin-4-ylpentan-1-one;4,4-dimethylpentanoic acid;4,4-dimethylpentan-1-ol;7-(2,2-dimethylpropyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine;4,4-dimethyl-1-pyrrolidin-1-ylpentan-1-one;(E)-4,4-dimethyl-1-pyrrolidin-1-ylpent-2-en-1-one;ethyl 4,4-dimethylpentanoate;1-(1H-indazol-5-yl)-5,5-dimethylhexan-2-one;1-(3H-isoindol-5-yl)-5,5-dimethylhexan-2-one;2-methoxy-2,5,5-trimethylhex-3-yne;2,2,5,5-tetramethylhex-3-yne;1,1,1-trideuterio-2,5,5-trimethylhex-3-yn-2-ol;2,5,5-trimethylhex-1-en-3-yne;2,5,5-trimethylhex-3-yn-2-ol?

The InChIKey is GRPODSOJRNUDGK-HEBHVIIVSA-N. The full InChI is InChI=1S/C16H21NO.C15H18N2O3.C15H20N2O.C14H23NO.C13H22N2.C11H21NO2.C11H21NO.C11H19NO.C11H20O.C11H18O.C10H18N4.C10H18O.C10H18.C9H18O2.2C9H16O.C9H14.C8H18O.C7H14O2.C7H16O/c1-16(2,3)7-6-15(18)9-12-4-5-13-10-17-11-14(13)8-12;1-4-5-10(18)6-12-11-7-14(19-2)15(20-3)8-13(11)17-9-16-12;1-15(2,3)7-6-13(18)9-11-4-5-14-12(8-11)10-16-17-14;1-14(2,3)9-5-7-11-16-12-13-8-4-6-10-15-13;1-13(2,3)9-5-7-11-15-12-8-4-6-10-14-12;1-11(2,3)5-4-10(13)12-6-8-14-9-7-12;2*1-11(2,3)7-6-10(13)12-8-4-5-9-12;2*1-11(2,3)7-6-10(12)8-9-4-5-9;1-10(2,3)7-13-4-5-14-9(6-13)11-8-12-14;1-9(2,3)7-8-10(4,5)11-6;1-9(2,3)7-8-10(4,5)6;1-5-11-8(10)6-7-9(2,3)4;2*1-8(2,3)6-7-9(4,5)10;1-8(2)6-7-9(3,4)5;1-8(2,3)6-4-5-7-9;1-7(2,3)5-4-6(8)9;1-7(2,3)5-4-6-8/h4-5,8,10H,6-7,9,11H2,1-3H3;7-9H,4-6H2,1-3H3;4-5,8,10H,6-7,9H2,1-3H3,(H,16,17);4,6,8,10H,5,7,9,11-12H2,1-3H3;4,6,8,10H,5,7,9,11H2,1-3H3,(H,14,15);4-9H2,1-3H3;4-9H2,1-3H3;6-7H,4-5,8-9H2,1-3H3;9H,4-8H2,1-3H3;6-7,9H,4-5,8H2,1-3H3;8H,4-7H2,1-3H3;1-6H3;1-6H3;5-7H2,1-4H3;2*10H,1-5H3;1H2,2-5H3;9H,4-7H2,1-3H3;4-5H2,1-3H3,(H,8,9);8H,4-6H2,1-3H3/b;;;;;;;7-6+;;7-6+;;;;;;;;;;/i;;;;;;;;;;;;;;4D3;;;;;.

What are the key properties of 1-cyclopropyl-5,5-dimethylhexan-2-one;(E)-1-cyclopropyl-5,5-dimethylhex-3-en-2-one;1-(6,7-dimethoxyquinazolin-4-yl)pentan-2-one;5,5-dimethylhexan-1-ol;2-(5,5-dimethylhexoxymethyl)pyridine;N-(5,5-dimethylhexyl)pyridin-2-amine;4,4-dimethyl-1-morpholin-4-ylpentan-1-one;4,4-dimethylpentanoic acid;4,4-dimethylpentan-1-ol;7-(2,2-dimethylpropyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine;4,4-dimethyl-1-pyrrolidin-1-ylpentan-1-one;(E)-4,4-dimethyl-1-pyrrolidin-1-ylpent-2-en-1-one;ethyl 4,4-dimethylpentanoate;1-(1H-indazol-5-yl)-5,5-dimethylhexan-2-one;1-(3H-isoindol-5-yl)-5,5-dimethylhexan-2-one;2-methoxy-2,5,5-trimethylhex-3-yne;2,2,5,5-tetramethylhex-3-yne;1,1,1-trideuterio-2,5,5-trimethylhex-3-yn-2-ol;2,5,5-trimethylhex-1-en-3-yne;2,5,5-trimethylhex-3-yn-2-ol?

1-cyclopropyl-5,5-dimethylhexan-2-one;(E)-1-cyclopropyl-5,5-dimethylhex-3-en-2-one;1-(6,7-dimethoxyquinazolin-4-yl)pentan-2-one;5,5-dimethylhexan-1-ol;2-(5,5-dimethylhexoxymethyl)pyridine;N-(5,5-dimethylhexyl)pyridin-2-amine;4,4-dimethyl-1-morpholin-4-ylpentan-1-one;4,4-dimethylpentanoic acid;4,4-dimethylpentan-1-ol;7-(2,2-dimethylpropyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine;4,4-dimethyl-1-pyrrolidin-1-ylpentan-1-one;(E)-4,4-dimethyl-1-pyrrolidin-1-ylpent-2-en-1-one;ethyl 4,4-dimethylpentanoate;1-(1H-indazol-5-yl)-5,5-dimethylhexan-2-one;1-(3H-isoindol-5-yl)-5,5-dimethylhexan-2-one;2-methoxy-2,5,5-trimethylhex-3-yne;2,2,5,5-tetramethylhex-3-yne;1,1,1-trideuterio-2,5,5-trimethylhex-3-yn-2-ol;2,5,5-trimethylhex-1-en-3-yne;2,5,5-trimethylhex-3-yn-2-ol has a molecular weight of 3515.43 g/mol, XLogP of 50.78, 50 rotatable bonds, 7 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 1-cyclopropyl-5,5-dimethylhexan-2-one;(E)-1-cyclopropyl-5,5-dimethylhex-3-en-2-one;1-(6,7-dimethoxyquinazolin-4-yl)pentan-2-one;5,5-dimethylhexan-1-ol;2-(5,5-dimethylhexoxymethyl)pyridine;N-(5,5-dimethylhexyl)pyridin-2-amine;4,4-dimethyl-1-morpholin-4-ylpentan-1-one;4,4-dimethylpentanoic acid;4,4-dimethylpentan-1-ol;7-(2,2-dimethylpropyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine;4,4-dimethyl-1-pyrrolidin-1-ylpentan-1-one;(E)-4,4-dimethyl-1-pyrrolidin-1-ylpent-2-en-1-one;ethyl 4,4-dimethylpentanoate;1-(1H-indazol-5-yl)-5,5-dimethylhexan-2-one;1-(3H-isoindol-5-yl)-5,5-dimethylhexan-2-one;2-methoxy-2,5,5-trimethylhex-3-yne;2,2,5,5-tetramethylhex-3-yne;1,1,1-trideuterio-2,5,5-trimethylhex-3-yn-2-ol;2,5,5-trimethylhex-1-en-3-yne;2,5,5-trimethylhex-3-yn-2-ol is sourced from PubChem (CID 158344914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).