(2R)-N-[5-[1-(cyclopropanecarbonyl)azetidin-3-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2R)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2R)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2S)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide;(2R)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide

C206H234N28O21 — CID 165109123

IUPAC(2R)-N-[5-[1-(cyclopropanecarbonyl)azetidin-3-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2R)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2R)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2S)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide;(2R)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide
SMILESCc1ccc(CCC[C@@H](C(=O)Nc2ccc(OCCN3CCOC3=O)cn2)c2ccccc2)cc1.Cc1ccc(CCC[C@H](C(=O)Nc2ccc(OCCN3CCOC3=O)cn2)c2ccccc2)cc1.Cc1ccc(CCN[C@@H](C(=O)Nc2ccc(OC(C)c3cnn(C)c3)cn2)c2ccccc2)cc1.Cc1ccc(CCN[C@H](C(=O)Nc2ccc(OC(C)c3cnn(C)c3)cn2)c2ccccc2)cc1.Cc1ccc([C@H](C)CN[C@@H](C(=O)Nc2ccc(OC3CCN(C(=O)C4CC4)CC3)cn2)c2ccccc2)cc1.Cc1ccc([C@H](C)CN[C@@H](C(=O)Nc2ccc(OC3CN(C(=O)C4CC4)C3)cn2)c2ccccc2)cc1.Cc1ccc([C@H](C)CN[C@H](C(=O)Nc2ccc(OC3CCN(C(=O)C4CC4)CC3)cn2)c2ccccc2)cc1
InChIInChI=1S/2C32H38N4O3.C30H34N4O3.2C28H31N5O2.2C28H31N3O4/c2*1-22-8-10-24(11-9-22)23(2)20-34-30(25-6-4-3-5-7-25)31(37)35-29-15-14-28(21-33-29)39-27-16-18-36(19-17-27)32(38)26-12-13-26;1-20-8-10-22(11-9-20)21(2)16-32-28(23-6-4-3-5-7-23)29(35)33-27-15-14-25(17-31-27)37-26-18-34(19-26)30(36)24-12-13-24;2*1-20-9-11-22(12-10-20)15-16-29-27(23-7-5-4-6-8-23)28(34)32-26-14-13-25(18-30-26)35-21(2)24-17-31-33(3)19-24;2*1-21-10-12-22(13-11-21)6-5-9-25(23-7-3-2-4-8-23)27(32)30-26-15-14-24(20-29-26)34-18-16-31-17-19-35-28(31)33/h2*3-11,14-15,21,23,26-27,30,34H,12-13,16-20H2,1-2H3,(H,33,35,37);3-11,14-15,17,21,24,26,28,32H,12-13,16,18-19H2,1-2H3,(H,31,33,35);2*4-14,17-19,21,27,29H,15-16H2,1-3H3,(H,30,32,34);2*2-4,7-8,10-15,20,25H,5-6,9,16-19H2,1H3,(H,29,30,32)/t23-,30+;23-,30-;21-,28-;2*21?,27-;2*25-/m1111010/s1
InChIKeyZQOUBWZZBJUNLC-BIJGMGKESA-N
MW3438.31 g/mol
LogP34.43
Rot. Bonds72

About (2R)-N-[5-[1-(cyclopropanecarbonyl)azetidin-3-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2R)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2R)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2S)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide;(2R)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide

(2R)-N-[5-[1-(cyclopropanecarbonyl)azetidin-3-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2R)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2R)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2S)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide;(2R)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide (PubChem CID 165109123) has the molecular formula C206H234N28O21 and a molecular weight of 3438.31 g/mol. Its IUPAC name is (2R)-N-[5-[1-(cyclopropanecarbonyl)azetidin-3-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2R)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2R)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2S)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide;(2R)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide.

Molecular Properties

Compound Name(2R)-N-[5-[1-(cyclopropanecarbonyl)azetidin-3-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2R)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2R)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2S)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide;(2R)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide
PubChem CID165109123
Molecular FormulaC206H234N28O21
Molecular Weight3438.31 g/mol
Exact Mass3435.81
IUPAC Name(2R)-N-[5-[1-(cyclopropanecarbonyl)azetidin-3-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2R)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2R)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2S)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide;(2R)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide
SMILESCc1ccc(CCC[C@@H](C(=O)Nc2ccc(OCCN3CCOC3=O)cn2)c2ccccc2)cc1.Cc1ccc(CCC[C@H](C(=O)Nc2ccc(OCCN3CCOC3=O)cn2)c2ccccc2)cc1.Cc1ccc(CCN[C@@H](C(=O)Nc2ccc(OC(C)c3cnn(C)c3)cn2)c2ccccc2)cc1.Cc1ccc(CCN[C@H](C(=O)Nc2ccc(OC(C)c3cnn(C)c3)cn2)c2ccccc2)cc1.Cc1ccc([C@H](C)CN[C@@H](C(=O)Nc2ccc(OC3CCN(C(=O)C4CC4)CC3)cn2)c2ccccc2)cc1.Cc1ccc([C@H](C)CN[C@@H](C(=O)Nc2ccc(OC3CN(C(=O)C4CC4)C3)cn2)c2ccccc2)cc1.Cc1ccc([C@H](C)CN[C@H](C(=O)Nc2ccc(OC3CCN(C(=O)C4CC4)CC3)cn2)c2ccccc2)cc1
InChIInChI=1S/2C32H38N4O3.C30H34N4O3.2C28H31N5O2.2C28H31N3O4/c2*1-22-8-10-24(11-9-22)23(2)20-34-30(25-6-4-3-5-7-25)31(37)35-29-15-14-28(21-33-29)39-27-16-18-36(19-17-27)32(38)26-12-13-26;1-20-8-10-22(11-9-20)21(2)16-32-28(23-6-4-3-5-7-23)29(35)33-27-15-14-25(17-31-27)37-26-18-34(19-26)30(36)24-12-13-24;2*1-20-9-11-22(12-10-20)15-16-29-27(23-7-5-4-6-8-23)28(34)32-26-14-13-25(18-30-26)35-21(2)24-17-31-33(3)19-24;2*1-21-10-12-22(13-11-21)6-5-9-25(23-7-3-2-4-8-23)27(32)30-26-15-14-24(20-29-26)34-18-16-31-17-19-35-28(31)33/h2*3-11,14-15,21,23,26-27,30,34H,12-13,16-20H2,1-2H3,(H,33,35,37);3-11,14-15,17,21,24,26,28,32H,12-13,16,18-19H2,1-2H3,(H,31,33,35);2*4-14,17-19,21,27,29H,15-16H2,1-3H3,(H,30,32,34);2*2-4,7-8,10-15,20,25H,5-6,9,16-19H2,1H3,(H,29,30,32)/t23-,30+;23-,30-;21-,28-;2*21?,27-;2*25-/m1111010/s1
InChIKeyZQOUBWZZBJUNLC-BIJGMGKESA-N
XLogP34.43
TPSA574.34 Ų
H-Bond Donors12
H-Bond Acceptors37
Rotatable Bonds72
Heavy Atoms255
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003438.31
LogP ≤ 534.43
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1037

Analyze (2R)-N-[5-[1-(cyclopropanecarbonyl)azetidin-3-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2R)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2R)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2S)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide;(2R)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide with MolForge

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Related Compounds

(2S)-2-[2-(4-cyanophenyl)propylamino]-N-[5-[1-(cyclopropanecarbonyl)azetidin-3-yl]oxy-2-pyridinyl]-2-phenylacetamide
CID 175623239
(2R)-2-[2-(4-methylphenyl)ethylamino]-N-[5-(oxolan-3-yloxy)-2-pyridinyl]-2-phenylacetamide
CID 165021666
N-[5-(1-acetylpiperidin-4-yl)oxy-2-pyridinyl]-2-[2-(4-cyanophenyl)ethylamino]-2-phenylacetamide
CID 154694146
N-[5-(1-acetylazetidin-3-yl)oxy-2-pyridinyl]-2-[2-(4-cyanophenyl)ethylamino]-2-(1-methylpyrazol-4-yl)acetamide
CID 175622672
(2R)-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-N-[5-(1-methylpyrazol-4-yl)-2-pyridinyl]-2-phenylacetamide
CID 157190906
N-[5-(1-acetylpiperidin-3-yl)oxy-2-pyridinyl]-2-[2-(4-cyanophenyl)ethylamino]-2-phenylacetamide
CID 175622897
(2S)-N-[5-(1,3-dimethylpyrazol-4-yl)-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2R)-N-[5-(1,3-dimethylpyrazol-4-yl)-2-pyridinyl]-2-[2-(4-methylphenyl)propylamino]-2-phenylacetamide;(2S)-2-(2-fluorophenyl)-2-[2-(4-methylphenyl)ethylamino]-N-[5-(1-methylpyrazol-4-yl)-2-pyridinyl]acetamide;(2R)-2-(2-fluorophenyl)-2-[2-(4-methylphenyl)ethylamino]-N-[5-(1-methylpyrazol-4-yl)-2-pyridinyl]acetamide;(2S)-2-(3-fluorophenyl)-2-[2-(4-methylphenyl)ethylamino]-N-[5-(1-methylpyrazol-4-yl)-2-pyridinyl]acetamide;(2R)-2-(3-fluorophenyl)-2-[2-(4-methylphenyl)ethylamino]-N-[5-(1-methylpyrazol-4-yl)-2-pyridinyl]acetamide;(2S)-N-[5-(1-methyl-5-oxopyrrolidin-3-yl)-2-pyridinyl]-2-[2-(4-methylphenyl)propylamino]-2-phenylacetamide
CID 167706592
(2R)-N-[5-(1,3-dimethylpyrazol-4-yl)-2-pyridinyl]-2-[2-(4-methylphenyl)propylamino]-2-phenylacetamide
CID 167706593
(2R)-2-[2-(4-methylphenyl)ethylamino]-N-[5-(5-methylpyrimidin-2-yl)oxy-2-pyridinyl]-2-phenylacetamide
CID 165012910
(2S)-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-N-[5-(2-methyltriazol-4-yl)-2-pyridinyl]-2-phenylacetamide
CID 157190903
(2S)-2-[2-(4-chlorophenyl)ethylamino]-2-phenyl-N-[5-(2-pyrazol-1-ylethoxy)-2-pyridinyl]acetamide
CID 175623083
N-[5-(azetidin-3-yloxy)-2-pyridinyl]-2-[[(2S)-2-(4-cyanophenyl)propyl]amino]-2-phenylacetamide
CID 164756425

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[5-[1-(cyclopropanecarbonyl)azetidin-3-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2R)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2R)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2S)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide;(2R)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide?
The IUPAC name of (2R)-N-[5-[1-(cyclopropanecarbonyl)azetidin-3-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2R)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2R)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2S)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide;(2R)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide (CID 165109123) is (2R)-N-[5-[1-(cyclopropanecarbonyl)azetidin-3-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2R)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2R)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2S)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide;(2R)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide.
What is the SMILES notation for (2R)-N-[5-[1-(cyclopropanecarbonyl)azetidin-3-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2R)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2R)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2S)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide;(2R)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide?
The canonical SMILES for (2R)-N-[5-[1-(cyclopropanecarbonyl)azetidin-3-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2R)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2R)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2S)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide;(2R)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide is Cc1ccc(CCC[C@@H](C(=O)Nc2ccc(OCCN3CCOC3=O)cn2)c2ccccc2)cc1.Cc1ccc(CCC[C@H](C(=O)Nc2ccc(OCCN3CCOC3=O)cn2)c2ccccc2)cc1.Cc1ccc(CCN[C@@H](C(=O)Nc2ccc(OC(C)c3cnn(C)c3)cn2)c2ccccc2)cc1.Cc1ccc(CCN[C@H](C(=O)Nc2ccc(OC(C)c3cnn(C)c3)cn2)c2ccccc2)cc1.Cc1ccc([C@H](C)CN[C@@H](C(=O)Nc2ccc(OC3CCN(C(=O)C4CC4)CC3)cn2)c2ccccc2)cc1.Cc1ccc([C@H](C)CN[C@@H](C(=O)Nc2ccc(OC3CN(C(=O)C4CC4)C3)cn2)c2ccccc2)cc1.Cc1ccc([C@H](C)CN[C@H](C(=O)Nc2ccc(OC3CCN(C(=O)C4CC4)CC3)cn2)c2ccccc2)cc1.
What is the InChIKey of (2R)-N-[5-[1-(cyclopropanecarbonyl)azetidin-3-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2R)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2R)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2S)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide;(2R)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide?
The InChIKey is ZQOUBWZZBJUNLC-BIJGMGKESA-N. The full InChI is InChI=1S/2C32H38N4O3.C30H34N4O3.2C28H31N5O2.2C28H31N3O4/c2*1-22-8-10-24(11-9-22)23(2)20-34-30(25-6-4-3-5-7-25)31(37)35-29-15-14-28(21-33-29)39-27-16-18-36(19-17-27)32(38)26-12-13-26;1-20-8-10-22(11-9-20)21(2)16-32-28(23-6-4-3-5-7-23)29(35)33-27-15-14-25(17-31-27)37-26-18-34(19-26)30(36)24-12-13-24;2*1-20-9-11-22(12-10-20)15-16-29-27(23-7-5-4-6-8-23)28(34)32-26-14-13-25(18-30-26)35-21(2)24-17-31-33(3)19-24;2*1-21-10-12-22(13-11-21)6-5-9-25(23-7-3-2-4-8-23)27(32)30-26-15-14-24(20-29-26)34-18-16-31-17-19-35-28(31)33/h2*3-11,14-15,21,23,26-27,30,34H,12-13,16-20H2,1-2H3,(H,33,35,37);3-11,14-15,17,21,24,26,28,32H,12-13,16,18-19H2,1-2H3,(H,31,33,35);2*4-14,17-19,21,27,29H,15-16H2,1-3H3,(H,30,32,34);2*2-4,7-8,10-15,20,25H,5-6,9,16-19H2,1H3,(H,29,30,32)/t23-,30+;23-,30-;21-,28-;2*21?,27-;2*25-/m1111010/s1.
What are the key properties of (2R)-N-[5-[1-(cyclopropanecarbonyl)azetidin-3-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2R)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2R)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2S)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide;(2R)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide?
(2R)-N-[5-[1-(cyclopropanecarbonyl)azetidin-3-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2R)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2R)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2S)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide;(2R)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide has a molecular weight of 3438.31 g/mol, XLogP of 34.43, 72 rotatable bonds, 12 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[5-[1-(cyclopropanecarbonyl)azetidin-3-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2R)-N-[5-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-2-pyridinyl]-2-[[(2S)-2-(4-methylphenyl)propyl]amino]-2-phenylacetamide;(2S)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2R)-2-[2-(4-methylphenyl)ethylamino]-N-[5-[1-(1-methylpyrazol-4-yl)ethoxy]-2-pyridinyl]-2-phenylacetamide;(2S)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide;(2R)-5-(4-methylphenyl)-N-[5-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]-2-pyridinyl]-2-phenylpentanamide is sourced from PubChem (CID 165109123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).