N,N-dimethyl-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(3-methylsulfonylpropyl)-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide;3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide

C174H182N18O18S — CID 160969328

IUPACN,N-dimethyl-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(3-methylsulfonylpropyl)-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide;3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide
SMILESCc1ccc(CCN[C@@H](C(=O)c2c[nH]c3cc(C(=O)NC4COC4)ccc23)c2ccccc2)cc1.Cc1ccc(CCN[C@@H](C(=O)c2c[nH]c3cc(C(=O)NCCCS(C)(=O)=O)ccc23)c2ccccc2)cc1.Cc1ccc(CCN[C@@H](C(=O)c2c[nH]c3cc(C(=O)NC[C@@H](C)O)ccc23)c2ccccc2)cc1.Cc1ccc(CCN[C@H](C(=O)c2c[nH]c3cc(C(=O)N(C)C)ccc23)c2ccccc2)cc1.Cc1ccc(CCN[C@H](C(=O)c2c[nH]c3cc(C(=O)NC4COC4)ccc23)c2ccccc2)cc1.Cc1ccc(CCN[C@H](C(=O)c2c[nH]c3cc(C(=O)NC[C@@H](C)O)ccc23)c2ccccc2)cc1
InChIInChI=1S/C30H33N3O4S.2C29H29N3O3.2C29H31N3O3.C28H29N3O2/c1-21-9-11-22(12-10-21)15-17-31-28(23-7-4-3-5-8-23)29(34)26-20-33-27-19-24(13-14-25(26)27)30(35)32-16-6-18-38(2,36)37;2*1-19-7-9-20(10-8-19)13-14-30-27(21-5-3-2-4-6-21)28(33)25-16-31-26-15-22(11-12-24(25)26)29(34)32-23-17-35-18-23;2*1-19-8-10-21(11-9-19)14-15-30-27(22-6-4-3-5-7-22)28(34)25-18-31-26-16-23(12-13-24(25)26)29(35)32-17-20(2)33;1-19-9-11-20(12-10-19)15-16-29-26(21-7-5-4-6-8-21)27(32)24-18-30-25-17-22(13-14-23(24)25)28(33)31(2)3/h3-5,7-14,19-20,28,31,33H,6,15-18H2,1-2H3,(H,32,35);2*2-12,15-16,23,27,30-31H,13-14,17-18H2,1H3,(H,32,34);2*3-13,16,18,20,27,30-31,33H,14-15,17H2,1-2H3,(H,32,35);4-14,17-18,26,29-30H,15-16H2,1-3H3/t28-;2*27-;20-,27+;20-,27-;26-/m110110/s1
InChIKeySYBAYFLKYQXZEY-GEGKPJOBSA-N
MW2845.54 g/mol
LogP26.74
Rot. Bonds58

About N,N-dimethyl-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(3-methylsulfonylpropyl)-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide;3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide

N,N-dimethyl-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(3-methylsulfonylpropyl)-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide;3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide (PubChem CID 160969328) has the molecular formula C174H182N18O18S and a molecular weight of 2845.54 g/mol. Its IUPAC name is N,N-dimethyl-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(3-methylsulfonylpropyl)-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide;3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(3-methylsulfonylpropyl)-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide;3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide
PubChem CID160969328
Molecular FormulaC174H182N18O18S
Molecular Weight2845.54 g/mol
Exact Mass2843.36
IUPAC NameN,N-dimethyl-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(3-methylsulfonylpropyl)-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide;3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide
SMILESCc1ccc(CCN[C@@H](C(=O)c2c[nH]c3cc(C(=O)NC4COC4)ccc23)c2ccccc2)cc1.Cc1ccc(CCN[C@@H](C(=O)c2c[nH]c3cc(C(=O)NCCCS(C)(=O)=O)ccc23)c2ccccc2)cc1.Cc1ccc(CCN[C@@H](C(=O)c2c[nH]c3cc(C(=O)NC[C@@H](C)O)ccc23)c2ccccc2)cc1.Cc1ccc(CCN[C@H](C(=O)c2c[nH]c3cc(C(=O)N(C)C)ccc23)c2ccccc2)cc1.Cc1ccc(CCN[C@H](C(=O)c2c[nH]c3cc(C(=O)NC4COC4)ccc23)c2ccccc2)cc1.Cc1ccc(CCN[C@H](C(=O)c2c[nH]c3cc(C(=O)NC[C@@H](C)O)ccc23)c2ccccc2)cc1
InChIInChI=1S/C30H33N3O4S.2C29H29N3O3.2C29H31N3O3.C28H29N3O2/c1-21-9-11-22(12-10-21)15-17-31-28(23-7-4-3-5-8-23)29(34)26-20-33-27-19-24(13-14-25(26)27)30(35)32-16-6-18-38(2,36)37;2*1-19-7-9-20(10-8-19)13-14-30-27(21-5-3-2-4-6-21)28(33)25-16-31-26-15-22(11-12-24(25)26)29(34)32-23-17-35-18-23;2*1-19-8-10-21(11-9-19)14-15-30-27(22-6-4-3-5-7-22)28(34)25-18-31-26-16-23(12-13-24(25)26)29(35)32-17-20(2)33;1-19-9-11-20(12-10-19)15-16-29-26(21-7-5-4-6-8-21)27(32)24-18-30-25-17-22(13-14-23(24)25)28(33)31(2)3/h3-5,7-14,19-20,28,31,33H,6,15-18H2,1-2H3,(H,32,35);2*2-12,15-16,23,27,30-31H,13-14,17-18H2,1H3,(H,32,34);2*3-13,16,18,20,27,30-31,33H,14-15,17H2,1-2H3,(H,32,35);4-14,17-18,26,29-30H,15-16H2,1-3H3/t28-;2*27-;20-,27+;20-,27-;26-/m110110/s1
InChIKeySYBAYFLKYQXZEY-GEGKPJOBSA-N
XLogP26.74
TPSA528.21 Ų
H-Bond Donors19
H-Bond Acceptors24
Rotatable Bonds58
Heavy Atoms211
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002845.54
LogP ≤ 526.74
H-Bond Donors ≤ 519
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

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

Analyze N,N-dimethyl-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(3-methylsulfonylpropyl)-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide;3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide with MolForge

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Related Compounds

N-[(2R)-2-hydroxypropyl]-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide
CID 160969332
3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(2-pyrrolidin-1-ylethyl)-1H-indole-6-carboxamide
CID 158666863
4-[2-[[(1S)-2-(6-methyl-1H-indol-3-yl)-2-oxo-1-phenylethyl]amino]ethyl]benzenesulfonamide
CID 139422932
1-[3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indol-6-yl]pyrrolidin-2-one
CID 159421118
3-[(2S)-2-[2-(4-cyanophenyl)ethylamino]-2-phenylacetyl]-N-propan-2-yl-1H-indole-6-carboxamide
CID 139422982
3-[2-[2-(4-cyanophenyl)ethylamino]-2-phenylacetyl]-N-propan-2-yl-1H-indole-6-carboxamide
CID 139423180
bis(3-methyl-1-[3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indol-6-yl]butan-1-one);bis(3-methyl-1-[3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indol-6-yl]butan-1-one);(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenyl-1-[6-(pyrrolidine-1-carbonyl)-1H-indol-3-yl]ethanone;(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenyl-1-[6-(pyrrolidine-1-carbonyl)-1H-indol-3-yl]ethanone
CID 160921808
3-[(2R)-2-[2-(4-cyanophenyl)ethylamino]-2-phenylacetyl]-N-[(2R)-1,1,1-trifluoropropan-2-yl]-1H-indole-6-carboxamide
CID 139422992
(2R)-1-[6-(1-ethylpyrazol-4-yl)-1H-indol-3-yl]-2-[2-(4-methylphenyl)ethylamino]-2-phenylethanone
CID 159919528
N-[(2S)-2-hydroxypropyl]-3-(2-phenylacetyl)-1H-indole-6-carboxamide
CID 139422991
methyl 4-[2-[[2-[6-(1-methylpyrazol-4-yl)-1H-indol-3-yl]-2-oxo-1-phenylethyl]amino]ethyl]benzoate
CID 139416223
(2S)-2-[2-(4-fluorophenyl)ethylamino]-2-phenyl-1-(6-pyridin-4-yl-1H-indol-3-yl)ethanone
CID 139423104

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(3-methylsulfonylpropyl)-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide;3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide?
The IUPAC name of N,N-dimethyl-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(3-methylsulfonylpropyl)-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide;3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide (CID 160969328) is N,N-dimethyl-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(3-methylsulfonylpropyl)-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide;3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide.
What is the SMILES notation for N,N-dimethyl-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(3-methylsulfonylpropyl)-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide;3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide?
The canonical SMILES for N,N-dimethyl-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(3-methylsulfonylpropyl)-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide;3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide is Cc1ccc(CCN[C@@H](C(=O)c2c[nH]c3cc(C(=O)NC4COC4)ccc23)c2ccccc2)cc1.Cc1ccc(CCN[C@@H](C(=O)c2c[nH]c3cc(C(=O)NCCCS(C)(=O)=O)ccc23)c2ccccc2)cc1.Cc1ccc(CCN[C@@H](C(=O)c2c[nH]c3cc(C(=O)NC[C@@H](C)O)ccc23)c2ccccc2)cc1.Cc1ccc(CCN[C@H](C(=O)c2c[nH]c3cc(C(=O)N(C)C)ccc23)c2ccccc2)cc1.Cc1ccc(CCN[C@H](C(=O)c2c[nH]c3cc(C(=O)NC4COC4)ccc23)c2ccccc2)cc1.Cc1ccc(CCN[C@H](C(=O)c2c[nH]c3cc(C(=O)NC[C@@H](C)O)ccc23)c2ccccc2)cc1.
What is the InChIKey of N,N-dimethyl-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(3-methylsulfonylpropyl)-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide;3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide?
The InChIKey is SYBAYFLKYQXZEY-GEGKPJOBSA-N. The full InChI is InChI=1S/C30H33N3O4S.2C29H29N3O3.2C29H31N3O3.C28H29N3O2/c1-21-9-11-22(12-10-21)15-17-31-28(23-7-4-3-5-8-23)29(34)26-20-33-27-19-24(13-14-25(26)27)30(35)32-16-6-18-38(2,36)37;2*1-19-7-9-20(10-8-19)13-14-30-27(21-5-3-2-4-6-21)28(33)25-16-31-26-15-22(11-12-24(25)26)29(34)32-23-17-35-18-23;2*1-19-8-10-21(11-9-19)14-15-30-27(22-6-4-3-5-7-22)28(34)25-18-31-26-16-23(12-13-24(25)26)29(35)32-17-20(2)33;1-19-9-11-20(12-10-19)15-16-29-26(21-7-5-4-6-8-21)27(32)24-18-30-25-17-22(13-14-23(24)25)28(33)31(2)3/h3-5,7-14,19-20,28,31,33H,6,15-18H2,1-2H3,(H,32,35);2*2-12,15-16,23,27,30-31H,13-14,17-18H2,1H3,(H,32,34);2*3-13,16,18,20,27,30-31,33H,14-15,17H2,1-2H3,(H,32,35);4-14,17-18,26,29-30H,15-16H2,1-3H3/t28-;2*27-;20-,27+;20-,27-;26-/m110110/s1.
What are the key properties of N,N-dimethyl-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(3-methylsulfonylpropyl)-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide;3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide?
N,N-dimethyl-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(3-methylsulfonylpropyl)-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide;3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide has a molecular weight of 2845.54 g/mol, XLogP of 26.74, 58 rotatable bonds, 19 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2R)-2-hydroxypropyl]-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(3-methylsulfonylpropyl)-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide;3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-(oxetan-3-yl)-1H-indole-6-carboxamide is sourced from PubChem (CID 160969328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).