1-cyclobutyl-2-methylpropan-1-one;1-cyclopropyl-2-methylpropan-1-one;1-(2-fluoro-2-methylcyclopropyl)-2-methylpropan-1-one;1-(furan-2-yl)-2-methylpropan-1-one;tris(2-methyl-1-(1-methylcyclopropyl)propan-1-one);2-methyl-1-(1-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(1-methylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(6-methyl-2-pyridinyl)propan-1-one;3-methyl-1-morpholin-4-ylbutan-2-one;1-(3-methyl-2-oxobutyl)pyrrolidin-2-one;2-methyl-1-[(2S)-oxolan-2-yl]propan-1-one;2-methyl-1-[(2R)-oxolan-2-yl]propan-1-one;(5R)-5-(2-methylpropanoyl)pyrrolidin-2-one;(5S)-5-(2-methylpropanoyl)pyrrolidin-2-one;2-methyl-1-pyrazin-2-ylpropan-1-one;4-methyl-1-pyrazol-1-ylpentan-3-one

C156H250FN15O26 — CID 158540212

IUPAC1-cyclobutyl-2-methylpropan-1-one;1-cyclopropyl-2-methylpropan-1-one;1-(2-fluoro-2-methylcyclopropyl)-2-methylpropan-1-one;1-(furan-2-yl)-2-methylpropan-1-one;tris(2-methyl-1-(1-methylcyclopropyl)propan-1-one);2-methyl-1-(1-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(1-methylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(6-methyl-2-pyridinyl)propan-1-one;3-methyl-1-morpholin-4-ylbutan-2-one;1-(3-methyl-2-oxobutyl)pyrrolidin-2-one;2-methyl-1-[(2S)-oxolan-2-yl]propan-1-one;2-methyl-1-[(2R)-oxolan-2-yl]propan-1-one;(5R)-5-(2-methylpropanoyl)pyrrolidin-2-one;(5S)-5-(2-methylpropanoyl)pyrrolidin-2-one;2-methyl-1-pyrazin-2-ylpropan-1-one;4-methyl-1-pyrazol-1-ylpentan-3-one
SMILESCC(C)C(=O)C1(C)CC1.CC(C)C(=O)C1(C)CC1.CC(C)C(=O)C1(C)CC1.CC(C)C(=O)C1CC1.CC(C)C(=O)C1CC1(C)F.CC(C)C(=O)C1CCC1.CC(C)C(=O)CCn1cccn1.CC(C)C(=O)CN1CCCC1=O.CC(C)C(=O)CN1CCOCC1.CC(C)C(=O)[C@@H]1CCC(=O)N1.CC(C)C(=O)[C@@H]1CCCO1.CC(C)C(=O)[C@H]1CCC(=O)N1.CC(C)C(=O)[C@H]1CCCO1.CC(C)C(=O)c1ccco1.CC(C)C(=O)c1ccn(C)n1.CC(C)C(=O)c1ccnn1C.CC(C)C(=O)c1cnccn1.CC(C)C(=O)c1cnn(C)c1.Cc1cccc(C(=O)C(C)C)n1
InChIInChI=1S/C10H13NO.C9H14N2O.C9H17NO2.C9H15NO2.C8H13FO.3C8H12N2O.C8H10N2O.2C8H13NO2.2C8H14O2.C8H10O2.4C8H14O.C7H12O/c1-7(2)10(12)9-6-4-5-8(3)11-9;1-8(2)9(12)4-7-11-6-3-5-10-11;1-8(2)9(11)7-10-3-5-12-6-4-10;1-7(2)8(11)6-10-5-3-4-9(10)12;1-5(2)7(10)6-4-8(6,3)9;1-6(2)8(11)7-4-9-10(3)5-7;1-6(2)8(11)7-4-5-10(3)9-7;1-6(2)8(11)7-4-5-9-10(7)3;1-6(2)8(11)7-5-9-3-4-10-7;2*1-5(2)8(11)6-3-4-7(10)9-6;3*1-6(2)8(9)7-4-3-5-10-7;3*1-6(2)7(9)8(3)4-5-8;1-6(2)8(9)7-4-3-5-7;1-5(2)7(8)6-3-4-6/h4-7H,1-3H3;3,5-6,8H,4,7H2,1-2H3;8H,3-7H2,1-2H3;7H,3-6H2,1-2H3;5-6H,4H2,1-3H3;3*4-6H,1-3H3;3-6H,1-2H3;2*5-6H,3-4H2,1-2H3,(H,9,10);2*6-7H,3-5H2,1-2H3;3-6H,1-2H3;3*6H,4-5H2,1-3H3;6-7H,3-5H2,1-2H3;5-6H,3-4H2,1-2H3/t;;;;;;;;;2*6-;2*7-;;;;;;/m.........1010....../s1
InChIKeyHOKSDPJMPRGAIN-PILRGLKPSA-N
MW2770.79 g/mol
LogP27.70
Rot. Bonds42

About 1-cyclobutyl-2-methylpropan-1-one;1-cyclopropyl-2-methylpropan-1-one;1-(2-fluoro-2-methylcyclopropyl)-2-methylpropan-1-one;1-(furan-2-yl)-2-methylpropan-1-one;tris(2-methyl-1-(1-methylcyclopropyl)propan-1-one);2-methyl-1-(1-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(1-methylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(6-methyl-2-pyridinyl)propan-1-one;3-methyl-1-morpholin-4-ylbutan-2-one;1-(3-methyl-2-oxobutyl)pyrrolidin-2-one;2-methyl-1-[(2S)-oxolan-2-yl]propan-1-one;2-methyl-1-[(2R)-oxolan-2-yl]propan-1-one;(5R)-5-(2-methylpropanoyl)pyrrolidin-2-one;(5S)-5-(2-methylpropanoyl)pyrrolidin-2-one;2-methyl-1-pyrazin-2-ylpropan-1-one;4-methyl-1-pyrazol-1-ylpentan-3-one

1-cyclobutyl-2-methylpropan-1-one;1-cyclopropyl-2-methylpropan-1-one;1-(2-fluoro-2-methylcyclopropyl)-2-methylpropan-1-one;1-(furan-2-yl)-2-methylpropan-1-one;tris(2-methyl-1-(1-methylcyclopropyl)propan-1-one);2-methyl-1-(1-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(1-methylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(6-methyl-2-pyridinyl)propan-1-one;3-methyl-1-morpholin-4-ylbutan-2-one;1-(3-methyl-2-oxobutyl)pyrrolidin-2-one;2-methyl-1-[(2S)-oxolan-2-yl]propan-1-one;2-methyl-1-[(2R)-oxolan-2-yl]propan-1-one;(5R)-5-(2-methylpropanoyl)pyrrolidin-2-one;(5S)-5-(2-methylpropanoyl)pyrrolidin-2-one;2-methyl-1-pyrazin-2-ylpropan-1-one;4-methyl-1-pyrazol-1-ylpentan-3-one (PubChem CID 158540212) has the molecular formula C156H250FN15O26 and a molecular weight of 2770.79 g/mol. Its IUPAC name is 1-cyclobutyl-2-methylpropan-1-one;1-cyclopropyl-2-methylpropan-1-one;1-(2-fluoro-2-methylcyclopropyl)-2-methylpropan-1-one;1-(furan-2-yl)-2-methylpropan-1-one;tris(2-methyl-1-(1-methylcyclopropyl)propan-1-one);2-methyl-1-(1-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(1-methylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(6-methyl-2-pyridinyl)propan-1-one;3-methyl-1-morpholin-4-ylbutan-2-one;1-(3-methyl-2-oxobutyl)pyrrolidin-2-one;2-methyl-1-[(2S)-oxolan-2-yl]propan-1-one;2-methyl-1-[(2R)-oxolan-2-yl]propan-1-one;(5R)-5-(2-methylpropanoyl)pyrrolidin-2-one;(5S)-5-(2-methylpropanoyl)pyrrolidin-2-one;2-methyl-1-pyrazin-2-ylpropan-1-one;4-methyl-1-pyrazol-1-ylpentan-3-one.

Molecular Properties

Compound Name1-cyclobutyl-2-methylpropan-1-one;1-cyclopropyl-2-methylpropan-1-one;1-(2-fluoro-2-methylcyclopropyl)-2-methylpropan-1-one;1-(furan-2-yl)-2-methylpropan-1-one;tris(2-methyl-1-(1-methylcyclopropyl)propan-1-one);2-methyl-1-(1-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(1-methylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(6-methyl-2-pyridinyl)propan-1-one;3-methyl-1-morpholin-4-ylbutan-2-one;1-(3-methyl-2-oxobutyl)pyrrolidin-2-one;2-methyl-1-[(2S)-oxolan-2-yl]propan-1-one;2-methyl-1-[(2R)-oxolan-2-yl]propan-1-one;(5R)-5-(2-methylpropanoyl)pyrrolidin-2-one;(5S)-5-(2-methylpropanoyl)pyrrolidin-2-one;2-methyl-1-pyrazin-2-ylpropan-1-one;4-methyl-1-pyrazol-1-ylpentan-3-one
PubChem CID158540212
Molecular FormulaC156H250FN15O26
Molecular Weight2770.79 g/mol
Exact Mass2768.87
IUPAC Name1-cyclobutyl-2-methylpropan-1-one;1-cyclopropyl-2-methylpropan-1-one;1-(2-fluoro-2-methylcyclopropyl)-2-methylpropan-1-one;1-(furan-2-yl)-2-methylpropan-1-one;tris(2-methyl-1-(1-methylcyclopropyl)propan-1-one);2-methyl-1-(1-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(1-methylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(6-methyl-2-pyridinyl)propan-1-one;3-methyl-1-morpholin-4-ylbutan-2-one;1-(3-methyl-2-oxobutyl)pyrrolidin-2-one;2-methyl-1-[(2S)-oxolan-2-yl]propan-1-one;2-methyl-1-[(2R)-oxolan-2-yl]propan-1-one;(5R)-5-(2-methylpropanoyl)pyrrolidin-2-one;(5S)-5-(2-methylpropanoyl)pyrrolidin-2-one;2-methyl-1-pyrazin-2-ylpropan-1-one;4-methyl-1-pyrazol-1-ylpentan-3-one
SMILESCC(C)C(=O)C1(C)CC1.CC(C)C(=O)C1(C)CC1.CC(C)C(=O)C1(C)CC1.CC(C)C(=O)C1CC1.CC(C)C(=O)C1CC1(C)F.CC(C)C(=O)C1CCC1.CC(C)C(=O)CCn1cccn1.CC(C)C(=O)CN1CCCC1=O.CC(C)C(=O)CN1CCOCC1.CC(C)C(=O)[C@@H]1CCC(=O)N1.CC(C)C(=O)[C@@H]1CCCO1.CC(C)C(=O)[C@H]1CCC(=O)N1.CC(C)C(=O)[C@H]1CCCO1.CC(C)C(=O)c1ccco1.CC(C)C(=O)c1ccn(C)n1.CC(C)C(=O)c1ccnn1C.CC(C)C(=O)c1cnccn1.CC(C)C(=O)c1cnn(C)c1.Cc1cccc(C(=O)C(C)C)n1
InChIInChI=1S/C10H13NO.C9H14N2O.C9H17NO2.C9H15NO2.C8H13FO.3C8H12N2O.C8H10N2O.2C8H13NO2.2C8H14O2.C8H10O2.4C8H14O.C7H12O/c1-7(2)10(12)9-6-4-5-8(3)11-9;1-8(2)9(12)4-7-11-6-3-5-10-11;1-8(2)9(11)7-10-3-5-12-6-4-10;1-7(2)8(11)6-10-5-3-4-9(10)12;1-5(2)7(10)6-4-8(6,3)9;1-6(2)8(11)7-4-9-10(3)5-7;1-6(2)8(11)7-4-5-10(3)9-7;1-6(2)8(11)7-4-5-9-10(7)3;1-6(2)8(11)7-5-9-3-4-10-7;2*1-5(2)8(11)6-3-4-7(10)9-6;3*1-6(2)8(9)7-4-3-5-10-7;3*1-6(2)7(9)8(3)4-5-8;1-6(2)8(9)7-4-3-5-7;1-5(2)7(8)6-3-4-6/h4-7H,1-3H3;3,5-6,8H,4,7H2,1-2H3;8H,3-7H2,1-2H3;7H,3-6H2,1-2H3;5-6H,4H2,1-3H3;3*4-6H,1-3H3;3-6H,1-2H3;2*5-6H,3-4H2,1-2H3,(H,9,10);2*6-7H,3-5H2,1-2H3;3-6H,1-2H3;3*6H,4-5H2,1-3H3;6-7H,3-5H2,1-2H3;5-6H,3-4H2,1-2H3/t;;;;;;;;;2*6-;2*7-;;;;;;/m.........1010....../s1
InChIKeyHOKSDPJMPRGAIN-PILRGLKPSA-N
XLogP27.70
TPSA556.86 Ų
H-Bond Donors2
H-Bond Acceptors38
Rotatable Bonds42
Heavy Atoms198
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002770.79
LogP ≤ 527.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1038

Analyze 1-cyclobutyl-2-methylpropan-1-one;1-cyclopropyl-2-methylpropan-1-one;1-(2-fluoro-2-methylcyclopropyl)-2-methylpropan-1-one;1-(furan-2-yl)-2-methylpropan-1-one;tris(2-methyl-1-(1-methylcyclopropyl)propan-1-one);2-methyl-1-(1-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(1-methylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(6-methyl-2-pyridinyl)propan-1-one;3-methyl-1-morpholin-4-ylbutan-2-one;1-(3-methyl-2-oxobutyl)pyrrolidin-2-one;2-methyl-1-[(2S)-oxolan-2-yl]propan-1-one;2-methyl-1-[(2R)-oxolan-2-yl]propan-1-one;(5R)-5-(2-methylpropanoyl)pyrrolidin-2-one;(5S)-5-(2-methylpropanoyl)pyrrolidin-2-one;2-methyl-1-pyrazin-2-ylpropan-1-one;4-methyl-1-pyrazol-1-ylpentan-3-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-2-methylpropan-1-one;1-cyclopropyl-2-methylpropan-1-one;1-(2-fluoro-2-methylcyclopropyl)-2-methylpropan-1-one;1-(furan-2-yl)-2-methylpropan-1-one;tris(2-methyl-1-(1-methylcyclopropyl)propan-1-one);2-methyl-1-(1-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(1-methylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(6-methyl-2-pyridinyl)propan-1-one;3-methyl-1-morpholin-4-ylbutan-2-one;1-(3-methyl-2-oxobutyl)pyrrolidin-2-one;2-methyl-1-[(2S)-oxolan-2-yl]propan-1-one;2-methyl-1-[(2R)-oxolan-2-yl]propan-1-one;(5R)-5-(2-methylpropanoyl)pyrrolidin-2-one;(5S)-5-(2-methylpropanoyl)pyrrolidin-2-one;2-methyl-1-pyrazin-2-ylpropan-1-one;4-methyl-1-pyrazol-1-ylpentan-3-one?
The IUPAC name of 1-cyclobutyl-2-methylpropan-1-one;1-cyclopropyl-2-methylpropan-1-one;1-(2-fluoro-2-methylcyclopropyl)-2-methylpropan-1-one;1-(furan-2-yl)-2-methylpropan-1-one;tris(2-methyl-1-(1-methylcyclopropyl)propan-1-one);2-methyl-1-(1-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(1-methylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(6-methyl-2-pyridinyl)propan-1-one;3-methyl-1-morpholin-4-ylbutan-2-one;1-(3-methyl-2-oxobutyl)pyrrolidin-2-one;2-methyl-1-[(2S)-oxolan-2-yl]propan-1-one;2-methyl-1-[(2R)-oxolan-2-yl]propan-1-one;(5R)-5-(2-methylpropanoyl)pyrrolidin-2-one;(5S)-5-(2-methylpropanoyl)pyrrolidin-2-one;2-methyl-1-pyrazin-2-ylpropan-1-one;4-methyl-1-pyrazol-1-ylpentan-3-one (CID 158540212) is 1-cyclobutyl-2-methylpropan-1-one;1-cyclopropyl-2-methylpropan-1-one;1-(2-fluoro-2-methylcyclopropyl)-2-methylpropan-1-one;1-(furan-2-yl)-2-methylpropan-1-one;tris(2-methyl-1-(1-methylcyclopropyl)propan-1-one);2-methyl-1-(1-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(1-methylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(6-methyl-2-pyridinyl)propan-1-one;3-methyl-1-morpholin-4-ylbutan-2-one;1-(3-methyl-2-oxobutyl)pyrrolidin-2-one;2-methyl-1-[(2S)-oxolan-2-yl]propan-1-one;2-methyl-1-[(2R)-oxolan-2-yl]propan-1-one;(5R)-5-(2-methylpropanoyl)pyrrolidin-2-one;(5S)-5-(2-methylpropanoyl)pyrrolidin-2-one;2-methyl-1-pyrazin-2-ylpropan-1-one;4-methyl-1-pyrazol-1-ylpentan-3-one.
What is the SMILES notation for 1-cyclobutyl-2-methylpropan-1-one;1-cyclopropyl-2-methylpropan-1-one;1-(2-fluoro-2-methylcyclopropyl)-2-methylpropan-1-one;1-(furan-2-yl)-2-methylpropan-1-one;tris(2-methyl-1-(1-methylcyclopropyl)propan-1-one);2-methyl-1-(1-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(1-methylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(6-methyl-2-pyridinyl)propan-1-one;3-methyl-1-morpholin-4-ylbutan-2-one;1-(3-methyl-2-oxobutyl)pyrrolidin-2-one;2-methyl-1-[(2S)-oxolan-2-yl]propan-1-one;2-methyl-1-[(2R)-oxolan-2-yl]propan-1-one;(5R)-5-(2-methylpropanoyl)pyrrolidin-2-one;(5S)-5-(2-methylpropanoyl)pyrrolidin-2-one;2-methyl-1-pyrazin-2-ylpropan-1-one;4-methyl-1-pyrazol-1-ylpentan-3-one?
The canonical SMILES for 1-cyclobutyl-2-methylpropan-1-one;1-cyclopropyl-2-methylpropan-1-one;1-(2-fluoro-2-methylcyclopropyl)-2-methylpropan-1-one;1-(furan-2-yl)-2-methylpropan-1-one;tris(2-methyl-1-(1-methylcyclopropyl)propan-1-one);2-methyl-1-(1-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(1-methylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(6-methyl-2-pyridinyl)propan-1-one;3-methyl-1-morpholin-4-ylbutan-2-one;1-(3-methyl-2-oxobutyl)pyrrolidin-2-one;2-methyl-1-[(2S)-oxolan-2-yl]propan-1-one;2-methyl-1-[(2R)-oxolan-2-yl]propan-1-one;(5R)-5-(2-methylpropanoyl)pyrrolidin-2-one;(5S)-5-(2-methylpropanoyl)pyrrolidin-2-one;2-methyl-1-pyrazin-2-ylpropan-1-one;4-methyl-1-pyrazol-1-ylpentan-3-one is CC(C)C(=O)C1(C)CC1.CC(C)C(=O)C1(C)CC1.CC(C)C(=O)C1(C)CC1.CC(C)C(=O)C1CC1.CC(C)C(=O)C1CC1(C)F.CC(C)C(=O)C1CCC1.CC(C)C(=O)CCn1cccn1.CC(C)C(=O)CN1CCCC1=O.CC(C)C(=O)CN1CCOCC1.CC(C)C(=O)[C@@H]1CCC(=O)N1.CC(C)C(=O)[C@@H]1CCCO1.CC(C)C(=O)[C@H]1CCC(=O)N1.CC(C)C(=O)[C@H]1CCCO1.CC(C)C(=O)c1ccco1.CC(C)C(=O)c1ccn(C)n1.CC(C)C(=O)c1ccnn1C.CC(C)C(=O)c1cnccn1.CC(C)C(=O)c1cnn(C)c1.Cc1cccc(C(=O)C(C)C)n1.
What is the InChIKey of 1-cyclobutyl-2-methylpropan-1-one;1-cyclopropyl-2-methylpropan-1-one;1-(2-fluoro-2-methylcyclopropyl)-2-methylpropan-1-one;1-(furan-2-yl)-2-methylpropan-1-one;tris(2-methyl-1-(1-methylcyclopropyl)propan-1-one);2-methyl-1-(1-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(1-methylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(6-methyl-2-pyridinyl)propan-1-one;3-methyl-1-morpholin-4-ylbutan-2-one;1-(3-methyl-2-oxobutyl)pyrrolidin-2-one;2-methyl-1-[(2S)-oxolan-2-yl]propan-1-one;2-methyl-1-[(2R)-oxolan-2-yl]propan-1-one;(5R)-5-(2-methylpropanoyl)pyrrolidin-2-one;(5S)-5-(2-methylpropanoyl)pyrrolidin-2-one;2-methyl-1-pyrazin-2-ylpropan-1-one;4-methyl-1-pyrazol-1-ylpentan-3-one?
The InChIKey is HOKSDPJMPRGAIN-PILRGLKPSA-N. The full InChI is InChI=1S/C10H13NO.C9H14N2O.C9H17NO2.C9H15NO2.C8H13FO.3C8H12N2O.C8H10N2O.2C8H13NO2.2C8H14O2.C8H10O2.4C8H14O.C7H12O/c1-7(2)10(12)9-6-4-5-8(3)11-9;1-8(2)9(12)4-7-11-6-3-5-10-11;1-8(2)9(11)7-10-3-5-12-6-4-10;1-7(2)8(11)6-10-5-3-4-9(10)12;1-5(2)7(10)6-4-8(6,3)9;1-6(2)8(11)7-4-9-10(3)5-7;1-6(2)8(11)7-4-5-10(3)9-7;1-6(2)8(11)7-4-5-9-10(7)3;1-6(2)8(11)7-5-9-3-4-10-7;2*1-5(2)8(11)6-3-4-7(10)9-6;3*1-6(2)8(9)7-4-3-5-10-7;3*1-6(2)7(9)8(3)4-5-8;1-6(2)8(9)7-4-3-5-7;1-5(2)7(8)6-3-4-6/h4-7H,1-3H3;3,5-6,8H,4,7H2,1-2H3;8H,3-7H2,1-2H3;7H,3-6H2,1-2H3;5-6H,4H2,1-3H3;3*4-6H,1-3H3;3-6H,1-2H3;2*5-6H,3-4H2,1-2H3,(H,9,10);2*6-7H,3-5H2,1-2H3;3-6H,1-2H3;3*6H,4-5H2,1-3H3;6-7H,3-5H2,1-2H3;5-6H,3-4H2,1-2H3/t;;;;;;;;;2*6-;2*7-;;;;;;/m.........1010....../s1.
What are the key properties of 1-cyclobutyl-2-methylpropan-1-one;1-cyclopropyl-2-methylpropan-1-one;1-(2-fluoro-2-methylcyclopropyl)-2-methylpropan-1-one;1-(furan-2-yl)-2-methylpropan-1-one;tris(2-methyl-1-(1-methylcyclopropyl)propan-1-one);2-methyl-1-(1-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(1-methylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(6-methyl-2-pyridinyl)propan-1-one;3-methyl-1-morpholin-4-ylbutan-2-one;1-(3-methyl-2-oxobutyl)pyrrolidin-2-one;2-methyl-1-[(2S)-oxolan-2-yl]propan-1-one;2-methyl-1-[(2R)-oxolan-2-yl]propan-1-one;(5R)-5-(2-methylpropanoyl)pyrrolidin-2-one;(5S)-5-(2-methylpropanoyl)pyrrolidin-2-one;2-methyl-1-pyrazin-2-ylpropan-1-one;4-methyl-1-pyrazol-1-ylpentan-3-one?
1-cyclobutyl-2-methylpropan-1-one;1-cyclopropyl-2-methylpropan-1-one;1-(2-fluoro-2-methylcyclopropyl)-2-methylpropan-1-one;1-(furan-2-yl)-2-methylpropan-1-one;tris(2-methyl-1-(1-methylcyclopropyl)propan-1-one);2-methyl-1-(1-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(1-methylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(6-methyl-2-pyridinyl)propan-1-one;3-methyl-1-morpholin-4-ylbutan-2-one;1-(3-methyl-2-oxobutyl)pyrrolidin-2-one;2-methyl-1-[(2S)-oxolan-2-yl]propan-1-one;2-methyl-1-[(2R)-oxolan-2-yl]propan-1-one;(5R)-5-(2-methylpropanoyl)pyrrolidin-2-one;(5S)-5-(2-methylpropanoyl)pyrrolidin-2-one;2-methyl-1-pyrazin-2-ylpropan-1-one;4-methyl-1-pyrazol-1-ylpentan-3-one has a molecular weight of 2770.79 g/mol, XLogP of 27.70, 42 rotatable bonds, 2 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-2-methylpropan-1-one;1-cyclopropyl-2-methylpropan-1-one;1-(2-fluoro-2-methylcyclopropyl)-2-methylpropan-1-one;1-(furan-2-yl)-2-methylpropan-1-one;tris(2-methyl-1-(1-methylcyclopropyl)propan-1-one);2-methyl-1-(1-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(1-methylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-methylpyrazol-3-yl)propan-1-one;2-methyl-1-(6-methyl-2-pyridinyl)propan-1-one;3-methyl-1-morpholin-4-ylbutan-2-one;1-(3-methyl-2-oxobutyl)pyrrolidin-2-one;2-methyl-1-[(2S)-oxolan-2-yl]propan-1-one;2-methyl-1-[(2R)-oxolan-2-yl]propan-1-one;(5R)-5-(2-methylpropanoyl)pyrrolidin-2-one;(5S)-5-(2-methylpropanoyl)pyrrolidin-2-one;2-methyl-1-pyrazin-2-ylpropan-1-one;4-methyl-1-pyrazol-1-ylpentan-3-one is sourced from PubChem (CID 158540212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).