(2S)-1-amino-2-(4-chlorophenyl)-4-methylpentan-3-one;(2S)-1-amino-2-(3,4-dichlorophenyl)-4-methylpentan-3-one;2-(4-bromophenyl)-4,4-dimethyl-1-(propan-2-ylamino)pentan-3-one;2-(4-chlorophenyl)-4,4-dimethyl-1-[methyl(propan-2-yl)amino]pentan-3-one;2-(4-chlorophenyl)-1-(ethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[(3S)-3-fluoropyrrolidin-1-yl]-4-methylpentan-3-one;2-(4-chlorophenyl)-1-(2-hydroxyethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-4,4-dimethylpentan-3-one;4-(4-chlorophenyl)-2-methyl-6-(4-methylcyclohexyl)hexan-3-one

C145H203BrCl9FN8O11 — CID 159385728

IUPAC(2S)-1-amino-2-(4-chlorophenyl)-4-methylpentan-3-one;(2S)-1-amino-2-(3,4-dichlorophenyl)-4-methylpentan-3-one;2-(4-bromophenyl)-4,4-dimethyl-1-(propan-2-ylamino)pentan-3-one;2-(4-chlorophenyl)-4,4-dimethyl-1-[methyl(propan-2-yl)amino]pentan-3-one;2-(4-chlorophenyl)-1-(ethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[(3S)-3-fluoropyrrolidin-1-yl]-4-methylpentan-3-one;2-(4-chlorophenyl)-1-(2-hydroxyethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-4,4-dimethylpentan-3-one;4-(4-chlorophenyl)-2-methyl-6-(4-methylcyclohexyl)hexan-3-one
SMILESCC(C)(C)C(=O)C(CNCCO)c1ccc(Cl)cc1.CC(C)C(=O)C(CN1CC[C@H](F)C1)c1ccc(Cl)cc1.CC(C)C(=O)[C@H](CN)c1ccc(Cl)c(Cl)c1.CC(C)C(=O)[C@H](CN)c1ccc(Cl)cc1.CC(C)N(C)CC(C(=O)C(C)(C)C)c1ccc(Cl)cc1.CC(C)NCC(C(=O)C(C)(C)C)c1ccc(Br)cc1.CC1CCC(CCC(C(=O)C(C)C)c2ccc(Cl)cc2)CC1.CCNCC(C(=O)C(C)(C)C)c1ccc(Cl)cc1.C[C@@H](NCC(C(=O)C(C)(C)C)c1ccc(Cl)cc1)[C@@H](O)c1ccccc1
InChIInChI=1S/C22H28ClNO2.C20H29ClO.C17H26ClNO.C16H24BrNO.C16H21ClFNO.C15H22ClNO2.C15H22ClNO.C12H15Cl2NO.C12H16ClNO/c1-15(20(25)17-8-6-5-7-9-17)24-14-19(21(26)22(2,3)4)16-10-12-18(23)13-11-16;1-14(2)20(22)19(17-9-11-18(21)12-10-17)13-8-16-6-4-15(3)5-7-16;1-12(2)19(6)11-15(16(20)17(3,4)5)13-7-9-14(18)10-8-13;1-11(2)18-10-14(15(19)16(3,4)5)12-6-8-13(17)9-7-12;1-11(2)16(20)15(10-19-8-7-14(18)9-19)12-3-5-13(17)6-4-12;1-15(2,3)14(19)13(10-17-8-9-18)11-4-6-12(16)7-5-11;1-5-17-10-13(14(18)15(2,3)4)11-6-8-12(16)9-7-11;1-7(2)12(16)9(6-15)8-3-4-10(13)11(14)5-8;1-8(2)12(15)11(7-14)9-3-5-10(13)6-4-9/h5-13,15,19-20,24-25H,14H2,1-4H3;9-12,14-16,19H,4-8,13H2,1-3H3;7-10,12,15H,11H2,1-6H3;6-9,11,14,18H,10H2,1-5H3;3-6,11,14-15H,7-10H2,1-2H3;4-7,13,17-18H,8-10H2,1-3H3;6-9,13,17H,5,10H2,1-4H3;3-5,7,9H,6,15H2,1-2H3;3-6,8,11H,7,14H2,1-2H3/t15-,19?,20-;;;;14-,15?;;;9-;11-/m1...0..11/s1
InChIKeyLLLUAAJPPQJMJX-KOXXIDPKSA-N
MW2652.24 g/mol
LogP35.36
Rot. Bonds47

About (2S)-1-amino-2-(4-chlorophenyl)-4-methylpentan-3-one;(2S)-1-amino-2-(3,4-dichlorophenyl)-4-methylpentan-3-one;2-(4-bromophenyl)-4,4-dimethyl-1-(propan-2-ylamino)pentan-3-one;2-(4-chlorophenyl)-4,4-dimethyl-1-[methyl(propan-2-yl)amino]pentan-3-one;2-(4-chlorophenyl)-1-(ethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[(3S)-3-fluoropyrrolidin-1-yl]-4-methylpentan-3-one;2-(4-chlorophenyl)-1-(2-hydroxyethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-4,4-dimethylpentan-3-one;4-(4-chlorophenyl)-2-methyl-6-(4-methylcyclohexyl)hexan-3-one

(2S)-1-amino-2-(4-chlorophenyl)-4-methylpentan-3-one;(2S)-1-amino-2-(3,4-dichlorophenyl)-4-methylpentan-3-one;2-(4-bromophenyl)-4,4-dimethyl-1-(propan-2-ylamino)pentan-3-one;2-(4-chlorophenyl)-4,4-dimethyl-1-[methyl(propan-2-yl)amino]pentan-3-one;2-(4-chlorophenyl)-1-(ethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[(3S)-3-fluoropyrrolidin-1-yl]-4-methylpentan-3-one;2-(4-chlorophenyl)-1-(2-hydroxyethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-4,4-dimethylpentan-3-one;4-(4-chlorophenyl)-2-methyl-6-(4-methylcyclohexyl)hexan-3-one (PubChem CID 159385728) has the molecular formula C145H203BrCl9FN8O11 and a molecular weight of 2652.24 g/mol. Its IUPAC name is (2S)-1-amino-2-(4-chlorophenyl)-4-methylpentan-3-one;(2S)-1-amino-2-(3,4-dichlorophenyl)-4-methylpentan-3-one;2-(4-bromophenyl)-4,4-dimethyl-1-(propan-2-ylamino)pentan-3-one;2-(4-chlorophenyl)-4,4-dimethyl-1-[methyl(propan-2-yl)amino]pentan-3-one;2-(4-chlorophenyl)-1-(ethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[(3S)-3-fluoropyrrolidin-1-yl]-4-methylpentan-3-one;2-(4-chlorophenyl)-1-(2-hydroxyethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-4,4-dimethylpentan-3-one;4-(4-chlorophenyl)-2-methyl-6-(4-methylcyclohexyl)hexan-3-one.

Molecular Properties

Compound Name(2S)-1-amino-2-(4-chlorophenyl)-4-methylpentan-3-one;(2S)-1-amino-2-(3,4-dichlorophenyl)-4-methylpentan-3-one;2-(4-bromophenyl)-4,4-dimethyl-1-(propan-2-ylamino)pentan-3-one;2-(4-chlorophenyl)-4,4-dimethyl-1-[methyl(propan-2-yl)amino]pentan-3-one;2-(4-chlorophenyl)-1-(ethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[(3S)-3-fluoropyrrolidin-1-yl]-4-methylpentan-3-one;2-(4-chlorophenyl)-1-(2-hydroxyethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-4,4-dimethylpentan-3-one;4-(4-chlorophenyl)-2-methyl-6-(4-methylcyclohexyl)hexan-3-one
PubChem CID159385728
Molecular FormulaC145H203BrCl9FN8O11
Molecular Weight2652.24 g/mol
Exact Mass2645.19
IUPAC Name(2S)-1-amino-2-(4-chlorophenyl)-4-methylpentan-3-one;(2S)-1-amino-2-(3,4-dichlorophenyl)-4-methylpentan-3-one;2-(4-bromophenyl)-4,4-dimethyl-1-(propan-2-ylamino)pentan-3-one;2-(4-chlorophenyl)-4,4-dimethyl-1-[methyl(propan-2-yl)amino]pentan-3-one;2-(4-chlorophenyl)-1-(ethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[(3S)-3-fluoropyrrolidin-1-yl]-4-methylpentan-3-one;2-(4-chlorophenyl)-1-(2-hydroxyethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-4,4-dimethylpentan-3-one;4-(4-chlorophenyl)-2-methyl-6-(4-methylcyclohexyl)hexan-3-one
SMILESCC(C)(C)C(=O)C(CNCCO)c1ccc(Cl)cc1.CC(C)C(=O)C(CN1CC[C@H](F)C1)c1ccc(Cl)cc1.CC(C)C(=O)[C@H](CN)c1ccc(Cl)c(Cl)c1.CC(C)C(=O)[C@H](CN)c1ccc(Cl)cc1.CC(C)N(C)CC(C(=O)C(C)(C)C)c1ccc(Cl)cc1.CC(C)NCC(C(=O)C(C)(C)C)c1ccc(Br)cc1.CC1CCC(CCC(C(=O)C(C)C)c2ccc(Cl)cc2)CC1.CCNCC(C(=O)C(C)(C)C)c1ccc(Cl)cc1.C[C@@H](NCC(C(=O)C(C)(C)C)c1ccc(Cl)cc1)[C@@H](O)c1ccccc1
InChIInChI=1S/C22H28ClNO2.C20H29ClO.C17H26ClNO.C16H24BrNO.C16H21ClFNO.C15H22ClNO2.C15H22ClNO.C12H15Cl2NO.C12H16ClNO/c1-15(20(25)17-8-6-5-7-9-17)24-14-19(21(26)22(2,3)4)16-10-12-18(23)13-11-16;1-14(2)20(22)19(17-9-11-18(21)12-10-17)13-8-16-6-4-15(3)5-7-16;1-12(2)19(6)11-15(16(20)17(3,4)5)13-7-9-14(18)10-8-13;1-11(2)18-10-14(15(19)16(3,4)5)12-6-8-13(17)9-7-12;1-11(2)16(20)15(10-19-8-7-14(18)9-19)12-3-5-13(17)6-4-12;1-15(2,3)14(19)13(10-17-8-9-18)11-4-6-12(16)7-5-11;1-5-17-10-13(14(18)15(2,3)4)11-6-8-12(16)9-7-11;1-7(2)12(16)9(6-15)8-3-4-10(13)11(14)5-8;1-8(2)12(15)11(7-14)9-3-5-10(13)6-4-9/h5-13,15,19-20,24-25H,14H2,1-4H3;9-12,14-16,19H,4-8,13H2,1-3H3;7-10,12,15H,11H2,1-6H3;6-9,11,14,18H,10H2,1-5H3;3-6,11,14-15H,7-10H2,1-2H3;4-7,13,17-18H,8-10H2,1-3H3;6-9,13,17H,5,10H2,1-4H3;3-5,7,9H,6,15H2,1-2H3;3-6,8,11H,7,14H2,1-2H3/t15-,19?,20-;;;;14-,15?;;;9-;11-/m1...0..11/s1
InChIKeyLLLUAAJPPQJMJX-KOXXIDPKSA-N
XLogP35.36
TPSA300.73 Ų
H-Bond Donors8
H-Bond Acceptors19
Rotatable Bonds47
Heavy Atoms175
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002652.24
LogP ≤ 535.36
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1019

Computed Properties (RDKit)

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

Analyze (2S)-1-amino-2-(4-chlorophenyl)-4-methylpentan-3-one;(2S)-1-amino-2-(3,4-dichlorophenyl)-4-methylpentan-3-one;2-(4-bromophenyl)-4,4-dimethyl-1-(propan-2-ylamino)pentan-3-one;2-(4-chlorophenyl)-4,4-dimethyl-1-[methyl(propan-2-yl)amino]pentan-3-one;2-(4-chlorophenyl)-1-(ethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[(3S)-3-fluoropyrrolidin-1-yl]-4-methylpentan-3-one;2-(4-chlorophenyl)-1-(2-hydroxyethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-4,4-dimethylpentan-3-one;4-(4-chlorophenyl)-2-methyl-6-(4-methylcyclohexyl)hexan-3-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of (2S)-1-amino-2-(4-chlorophenyl)-4-methylpentan-3-one;(2S)-1-amino-2-(3,4-dichlorophenyl)-4-methylpentan-3-one;2-(4-bromophenyl)-4,4-dimethyl-1-(propan-2-ylamino)pentan-3-one;2-(4-chlorophenyl)-4,4-dimethyl-1-[methyl(propan-2-yl)amino]pentan-3-one;2-(4-chlorophenyl)-1-(ethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[(3S)-3-fluoropyrrolidin-1-yl]-4-methylpentan-3-one;2-(4-chlorophenyl)-1-(2-hydroxyethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-4,4-dimethylpentan-3-one;4-(4-chlorophenyl)-2-methyl-6-(4-methylcyclohexyl)hexan-3-one?
The IUPAC name of (2S)-1-amino-2-(4-chlorophenyl)-4-methylpentan-3-one;(2S)-1-amino-2-(3,4-dichlorophenyl)-4-methylpentan-3-one;2-(4-bromophenyl)-4,4-dimethyl-1-(propan-2-ylamino)pentan-3-one;2-(4-chlorophenyl)-4,4-dimethyl-1-[methyl(propan-2-yl)amino]pentan-3-one;2-(4-chlorophenyl)-1-(ethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[(3S)-3-fluoropyrrolidin-1-yl]-4-methylpentan-3-one;2-(4-chlorophenyl)-1-(2-hydroxyethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-4,4-dimethylpentan-3-one;4-(4-chlorophenyl)-2-methyl-6-(4-methylcyclohexyl)hexan-3-one (CID 159385728) is (2S)-1-amino-2-(4-chlorophenyl)-4-methylpentan-3-one;(2S)-1-amino-2-(3,4-dichlorophenyl)-4-methylpentan-3-one;2-(4-bromophenyl)-4,4-dimethyl-1-(propan-2-ylamino)pentan-3-one;2-(4-chlorophenyl)-4,4-dimethyl-1-[methyl(propan-2-yl)amino]pentan-3-one;2-(4-chlorophenyl)-1-(ethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[(3S)-3-fluoropyrrolidin-1-yl]-4-methylpentan-3-one;2-(4-chlorophenyl)-1-(2-hydroxyethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-4,4-dimethylpentan-3-one;4-(4-chlorophenyl)-2-methyl-6-(4-methylcyclohexyl)hexan-3-one.
What is the SMILES notation for (2S)-1-amino-2-(4-chlorophenyl)-4-methylpentan-3-one;(2S)-1-amino-2-(3,4-dichlorophenyl)-4-methylpentan-3-one;2-(4-bromophenyl)-4,4-dimethyl-1-(propan-2-ylamino)pentan-3-one;2-(4-chlorophenyl)-4,4-dimethyl-1-[methyl(propan-2-yl)amino]pentan-3-one;2-(4-chlorophenyl)-1-(ethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[(3S)-3-fluoropyrrolidin-1-yl]-4-methylpentan-3-one;2-(4-chlorophenyl)-1-(2-hydroxyethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-4,4-dimethylpentan-3-one;4-(4-chlorophenyl)-2-methyl-6-(4-methylcyclohexyl)hexan-3-one?
The canonical SMILES for (2S)-1-amino-2-(4-chlorophenyl)-4-methylpentan-3-one;(2S)-1-amino-2-(3,4-dichlorophenyl)-4-methylpentan-3-one;2-(4-bromophenyl)-4,4-dimethyl-1-(propan-2-ylamino)pentan-3-one;2-(4-chlorophenyl)-4,4-dimethyl-1-[methyl(propan-2-yl)amino]pentan-3-one;2-(4-chlorophenyl)-1-(ethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[(3S)-3-fluoropyrrolidin-1-yl]-4-methylpentan-3-one;2-(4-chlorophenyl)-1-(2-hydroxyethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-4,4-dimethylpentan-3-one;4-(4-chlorophenyl)-2-methyl-6-(4-methylcyclohexyl)hexan-3-one is CC(C)(C)C(=O)C(CNCCO)c1ccc(Cl)cc1.CC(C)C(=O)C(CN1CC[C@H](F)C1)c1ccc(Cl)cc1.CC(C)C(=O)[C@H](CN)c1ccc(Cl)c(Cl)c1.CC(C)C(=O)[C@H](CN)c1ccc(Cl)cc1.CC(C)N(C)CC(C(=O)C(C)(C)C)c1ccc(Cl)cc1.CC(C)NCC(C(=O)C(C)(C)C)c1ccc(Br)cc1.CC1CCC(CCC(C(=O)C(C)C)c2ccc(Cl)cc2)CC1.CCNCC(C(=O)C(C)(C)C)c1ccc(Cl)cc1.C[C@@H](NCC(C(=O)C(C)(C)C)c1ccc(Cl)cc1)[C@@H](O)c1ccccc1.
What is the InChIKey of (2S)-1-amino-2-(4-chlorophenyl)-4-methylpentan-3-one;(2S)-1-amino-2-(3,4-dichlorophenyl)-4-methylpentan-3-one;2-(4-bromophenyl)-4,4-dimethyl-1-(propan-2-ylamino)pentan-3-one;2-(4-chlorophenyl)-4,4-dimethyl-1-[methyl(propan-2-yl)amino]pentan-3-one;2-(4-chlorophenyl)-1-(ethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[(3S)-3-fluoropyrrolidin-1-yl]-4-methylpentan-3-one;2-(4-chlorophenyl)-1-(2-hydroxyethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-4,4-dimethylpentan-3-one;4-(4-chlorophenyl)-2-methyl-6-(4-methylcyclohexyl)hexan-3-one?
The InChIKey is LLLUAAJPPQJMJX-KOXXIDPKSA-N. The full InChI is InChI=1S/C22H28ClNO2.C20H29ClO.C17H26ClNO.C16H24BrNO.C16H21ClFNO.C15H22ClNO2.C15H22ClNO.C12H15Cl2NO.C12H16ClNO/c1-15(20(25)17-8-6-5-7-9-17)24-14-19(21(26)22(2,3)4)16-10-12-18(23)13-11-16;1-14(2)20(22)19(17-9-11-18(21)12-10-17)13-8-16-6-4-15(3)5-7-16;1-12(2)19(6)11-15(16(20)17(3,4)5)13-7-9-14(18)10-8-13;1-11(2)18-10-14(15(19)16(3,4)5)12-6-8-13(17)9-7-12;1-11(2)16(20)15(10-19-8-7-14(18)9-19)12-3-5-13(17)6-4-12;1-15(2,3)14(19)13(10-17-8-9-18)11-4-6-12(16)7-5-11;1-5-17-10-13(14(18)15(2,3)4)11-6-8-12(16)9-7-11;1-7(2)12(16)9(6-15)8-3-4-10(13)11(14)5-8;1-8(2)12(15)11(7-14)9-3-5-10(13)6-4-9/h5-13,15,19-20,24-25H,14H2,1-4H3;9-12,14-16,19H,4-8,13H2,1-3H3;7-10,12,15H,11H2,1-6H3;6-9,11,14,18H,10H2,1-5H3;3-6,11,14-15H,7-10H2,1-2H3;4-7,13,17-18H,8-10H2,1-3H3;6-9,13,17H,5,10H2,1-4H3;3-5,7,9H,6,15H2,1-2H3;3-6,8,11H,7,14H2,1-2H3/t15-,19?,20-;;;;14-,15?;;;9-;11-/m1...0..11/s1.
What are the key properties of (2S)-1-amino-2-(4-chlorophenyl)-4-methylpentan-3-one;(2S)-1-amino-2-(3,4-dichlorophenyl)-4-methylpentan-3-one;2-(4-bromophenyl)-4,4-dimethyl-1-(propan-2-ylamino)pentan-3-one;2-(4-chlorophenyl)-4,4-dimethyl-1-[methyl(propan-2-yl)amino]pentan-3-one;2-(4-chlorophenyl)-1-(ethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[(3S)-3-fluoropyrrolidin-1-yl]-4-methylpentan-3-one;2-(4-chlorophenyl)-1-(2-hydroxyethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-4,4-dimethylpentan-3-one;4-(4-chlorophenyl)-2-methyl-6-(4-methylcyclohexyl)hexan-3-one?
(2S)-1-amino-2-(4-chlorophenyl)-4-methylpentan-3-one;(2S)-1-amino-2-(3,4-dichlorophenyl)-4-methylpentan-3-one;2-(4-bromophenyl)-4,4-dimethyl-1-(propan-2-ylamino)pentan-3-one;2-(4-chlorophenyl)-4,4-dimethyl-1-[methyl(propan-2-yl)amino]pentan-3-one;2-(4-chlorophenyl)-1-(ethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[(3S)-3-fluoropyrrolidin-1-yl]-4-methylpentan-3-one;2-(4-chlorophenyl)-1-(2-hydroxyethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-4,4-dimethylpentan-3-one;4-(4-chlorophenyl)-2-methyl-6-(4-methylcyclohexyl)hexan-3-one has a molecular weight of 2652.24 g/mol, XLogP of 35.36, 47 rotatable bonds, 8 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-amino-2-(4-chlorophenyl)-4-methylpentan-3-one;(2S)-1-amino-2-(3,4-dichlorophenyl)-4-methylpentan-3-one;2-(4-bromophenyl)-4,4-dimethyl-1-(propan-2-ylamino)pentan-3-one;2-(4-chlorophenyl)-4,4-dimethyl-1-[methyl(propan-2-yl)amino]pentan-3-one;2-(4-chlorophenyl)-1-(ethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[(3S)-3-fluoropyrrolidin-1-yl]-4-methylpentan-3-one;2-(4-chlorophenyl)-1-(2-hydroxyethylamino)-4,4-dimethylpentan-3-one;2-(4-chlorophenyl)-1-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-4,4-dimethylpentan-3-one;4-(4-chlorophenyl)-2-methyl-6-(4-methylcyclohexyl)hexan-3-one is sourced from PubChem (CID 159385728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).