N,N-dimethyl-3-(2-propan-2-yl-3-pyridinyl)benzamide;N,N-dimethyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(4-ethyl-2-methylphenyl)-2-propan-2-ylpyridine;N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(3-methylsulfonylphenyl)-2-propan-2-ylpyridine;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]ethanone;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]propan-1-one

C115H132N10O7S — CID 159258765

IUPACN,N-dimethyl-3-(2-propan-2-yl-3-pyridinyl)benzamide;N,N-dimethyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(4-ethyl-2-methylphenyl)-2-propan-2-ylpyridine;N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(3-methylsulfonylphenyl)-2-propan-2-ylpyridine;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]ethanone;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]propan-1-one
SMILESCC(=O)c1cccc(-c2cccnc2C(C)C)c1.CC(C)c1ncccc1-c1ccc(C(=O)N(C)C)cc1.CC(C)c1ncccc1-c1cccc(C(=O)N(C)C)c1.CC(C)c1ncccc1-c1cccc(S(C)(=O)=O)c1.CCC(=O)c1cccc(-c2cccnc2C(C)C)c1.CCc1ccc(-c2cccnc2C(C)C)c(C)c1.CNC(=O)c1ccc(-c2cccnc2C(C)C)cc1
InChIInChI=1S/2C17H20N2O.C17H19NO.C17H21N.C16H18N2O.C16H17NO.C15H17NO2S/c1-12(2)16-15(9-6-10-18-16)13-7-5-8-14(11-13)17(20)19(3)4;1-12(2)16-15(6-5-11-18-16)13-7-9-14(10-8-13)17(20)19(3)4;1-4-16(19)14-8-5-7-13(11-14)15-9-6-10-18-17(15)12(2)3;1-5-14-8-9-15(13(4)11-14)16-7-6-10-18-17(16)12(2)3;1-11(2)15-14(5-4-10-18-15)12-6-8-13(9-7-12)16(19)17-3;1-11(2)16-15(8-5-9-17-16)14-7-4-6-13(10-14)12(3)18;1-11(2)15-14(8-5-9-16-15)12-6-4-7-13(10-12)19(3,17)18/h2*5-12H,1-4H3;5-12H,4H2,1-3H3;6-12H,5H2,1-4H3;4-11H,1-3H3,(H,17,19);4-11H,1-3H3;4-11H,1-3H3
InChIKeyKWFWFHWILLGSOG-UHFFFAOYSA-N
MW1798.45 g/mol
LogP26.94
Rot. Bonds22

About N,N-dimethyl-3-(2-propan-2-yl-3-pyridinyl)benzamide;N,N-dimethyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(4-ethyl-2-methylphenyl)-2-propan-2-ylpyridine;N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(3-methylsulfonylphenyl)-2-propan-2-ylpyridine;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]ethanone;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]propan-1-one

N,N-dimethyl-3-(2-propan-2-yl-3-pyridinyl)benzamide;N,N-dimethyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(4-ethyl-2-methylphenyl)-2-propan-2-ylpyridine;N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(3-methylsulfonylphenyl)-2-propan-2-ylpyridine;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]ethanone;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]propan-1-one (PubChem CID 159258765) has the molecular formula C115H132N10O7S and a molecular weight of 1798.45 g/mol. Its IUPAC name is N,N-dimethyl-3-(2-propan-2-yl-3-pyridinyl)benzamide;N,N-dimethyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(4-ethyl-2-methylphenyl)-2-propan-2-ylpyridine;N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(3-methylsulfonylphenyl)-2-propan-2-ylpyridine;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]ethanone;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]propan-1-one.

Molecular Properties

Compound NameN,N-dimethyl-3-(2-propan-2-yl-3-pyridinyl)benzamide;N,N-dimethyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(4-ethyl-2-methylphenyl)-2-propan-2-ylpyridine;N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(3-methylsulfonylphenyl)-2-propan-2-ylpyridine;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]ethanone;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]propan-1-one
PubChem CID159258765
Molecular FormulaC115H132N10O7S
Molecular Weight1798.45 g/mol
Exact Mass1797.00
IUPAC NameN,N-dimethyl-3-(2-propan-2-yl-3-pyridinyl)benzamide;N,N-dimethyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(4-ethyl-2-methylphenyl)-2-propan-2-ylpyridine;N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(3-methylsulfonylphenyl)-2-propan-2-ylpyridine;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]ethanone;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]propan-1-one
SMILESCC(=O)c1cccc(-c2cccnc2C(C)C)c1.CC(C)c1ncccc1-c1ccc(C(=O)N(C)C)cc1.CC(C)c1ncccc1-c1cccc(C(=O)N(C)C)c1.CC(C)c1ncccc1-c1cccc(S(C)(=O)=O)c1.CCC(=O)c1cccc(-c2cccnc2C(C)C)c1.CCc1ccc(-c2cccnc2C(C)C)c(C)c1.CNC(=O)c1ccc(-c2cccnc2C(C)C)cc1
InChIInChI=1S/2C17H20N2O.C17H19NO.C17H21N.C16H18N2O.C16H17NO.C15H17NO2S/c1-12(2)16-15(9-6-10-18-16)13-7-5-8-14(11-13)17(20)19(3)4;1-12(2)16-15(6-5-11-18-16)13-7-9-14(10-8-13)17(20)19(3)4;1-4-16(19)14-8-5-7-13(11-14)15-9-6-10-18-17(15)12(2)3;1-5-14-8-9-15(13(4)11-14)16-7-6-10-18-17(16)12(2)3;1-11(2)15-14(5-4-10-18-15)12-6-8-13(9-7-12)16(19)17-3;1-11(2)16-15(8-5-9-17-16)14-7-4-6-13(10-14)12(3)18;1-11(2)15-14(8-5-9-16-15)12-6-4-7-13(10-12)19(3,17)18/h2*5-12H,1-4H3;5-12H,4H2,1-3H3;6-12H,5H2,1-4H3;4-11H,1-3H3,(H,17,19);4-11H,1-3H3;4-11H,1-3H3
InChIKeyKWFWFHWILLGSOG-UHFFFAOYSA-N
XLogP26.94
TPSA228.23 Ų
H-Bond Donors1
H-Bond Acceptors14
Rotatable Bonds22
Heavy Atoms133
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001798.45
LogP ≤ 526.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1014

Analyze N,N-dimethyl-3-(2-propan-2-yl-3-pyridinyl)benzamide;N,N-dimethyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(4-ethyl-2-methylphenyl)-2-propan-2-ylpyridine;N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(3-methylsulfonylphenyl)-2-propan-2-ylpyridine;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]ethanone;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]propan-1-one with MolForge

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Launch Full Analysis

Related Compounds

3-(4-chlorophenyl)-2-propan-2-ylpyridine;N,N-dimethyl-3-(2-propan-2-yl-3-pyridinyl)benzamide;N,N-dimethyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(4-methoxy-2,6-dimethylphenyl)-2-propan-2-ylpyridine;3-(4-methoxy-2-methylphenyl)-2-propan-2-ylpyridine;3-(2-methylphenyl)-2-propan-2-ylpyridine;N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(3-methylsulfonylphenyl)-2-propan-2-ylpyridine;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]ethanone;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]propan-1-one;2-propan-2-yl-3-[3-(2H-tetrazol-5-yl)phenyl]pyridine
CID 161221017
3-(3-methylsulfonylphenyl)-2-propan-2-ylpyridine
CID 90162283
N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide
CID 90162280
3-(3-ethylphenyl)-N,N-dimethylbenzamide
CID 20651355
N-methyl-4-quinolin-5-ylbenzamide
CID 119066467
N-[(1S)-2-methyl-1-(3-methyl-2-pyridinyl)propyl]-3-methylsulfonylbenzamide
CID 96550294
N-[(4-ethylphenyl)methyl]-3-methylsulfonyl-N-(pyridin-3-ylmethyl)benzamide
CID 39738224
3-(3-hydroxy-2-pyridinyl)-N,N-dimethylbenzamide
CID 53218059
N-methyl-3-methylsulfonyl-N-[(2-phenylphenyl)methyl]benzamide
CID 60618534
N-(3-methyl-2-pyridinyl)-3-propanoylbenzenesulfonamide
CID 60873792
3-[4-(hydroxymethyl)phenyl]-N-methylbenzamide
CID 172740220
3-(3-acetylphenyl)-N-methyl-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 171387338

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-(2-propan-2-yl-3-pyridinyl)benzamide;N,N-dimethyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(4-ethyl-2-methylphenyl)-2-propan-2-ylpyridine;N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(3-methylsulfonylphenyl)-2-propan-2-ylpyridine;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]ethanone;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]propan-1-one?
The IUPAC name of N,N-dimethyl-3-(2-propan-2-yl-3-pyridinyl)benzamide;N,N-dimethyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(4-ethyl-2-methylphenyl)-2-propan-2-ylpyridine;N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(3-methylsulfonylphenyl)-2-propan-2-ylpyridine;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]ethanone;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]propan-1-one (CID 159258765) is N,N-dimethyl-3-(2-propan-2-yl-3-pyridinyl)benzamide;N,N-dimethyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(4-ethyl-2-methylphenyl)-2-propan-2-ylpyridine;N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(3-methylsulfonylphenyl)-2-propan-2-ylpyridine;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]ethanone;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]propan-1-one.
What is the SMILES notation for N,N-dimethyl-3-(2-propan-2-yl-3-pyridinyl)benzamide;N,N-dimethyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(4-ethyl-2-methylphenyl)-2-propan-2-ylpyridine;N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(3-methylsulfonylphenyl)-2-propan-2-ylpyridine;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]ethanone;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]propan-1-one?
The canonical SMILES for N,N-dimethyl-3-(2-propan-2-yl-3-pyridinyl)benzamide;N,N-dimethyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(4-ethyl-2-methylphenyl)-2-propan-2-ylpyridine;N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(3-methylsulfonylphenyl)-2-propan-2-ylpyridine;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]ethanone;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]propan-1-one is CC(=O)c1cccc(-c2cccnc2C(C)C)c1.CC(C)c1ncccc1-c1ccc(C(=O)N(C)C)cc1.CC(C)c1ncccc1-c1cccc(C(=O)N(C)C)c1.CC(C)c1ncccc1-c1cccc(S(C)(=O)=O)c1.CCC(=O)c1cccc(-c2cccnc2C(C)C)c1.CCc1ccc(-c2cccnc2C(C)C)c(C)c1.CNC(=O)c1ccc(-c2cccnc2C(C)C)cc1.
What is the InChIKey of N,N-dimethyl-3-(2-propan-2-yl-3-pyridinyl)benzamide;N,N-dimethyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(4-ethyl-2-methylphenyl)-2-propan-2-ylpyridine;N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(3-methylsulfonylphenyl)-2-propan-2-ylpyridine;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]ethanone;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]propan-1-one?
The InChIKey is KWFWFHWILLGSOG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C17H20N2O.C17H19NO.C17H21N.C16H18N2O.C16H17NO.C15H17NO2S/c1-12(2)16-15(9-6-10-18-16)13-7-5-8-14(11-13)17(20)19(3)4;1-12(2)16-15(6-5-11-18-16)13-7-9-14(10-8-13)17(20)19(3)4;1-4-16(19)14-8-5-7-13(11-14)15-9-6-10-18-17(15)12(2)3;1-5-14-8-9-15(13(4)11-14)16-7-6-10-18-17(16)12(2)3;1-11(2)15-14(5-4-10-18-15)12-6-8-13(9-7-12)16(19)17-3;1-11(2)16-15(8-5-9-17-16)14-7-4-6-13(10-14)12(3)18;1-11(2)15-14(8-5-9-16-15)12-6-4-7-13(10-12)19(3,17)18/h2*5-12H,1-4H3;5-12H,4H2,1-3H3;6-12H,5H2,1-4H3;4-11H,1-3H3,(H,17,19);4-11H,1-3H3;4-11H,1-3H3.
What are the key properties of N,N-dimethyl-3-(2-propan-2-yl-3-pyridinyl)benzamide;N,N-dimethyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(4-ethyl-2-methylphenyl)-2-propan-2-ylpyridine;N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(3-methylsulfonylphenyl)-2-propan-2-ylpyridine;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]ethanone;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]propan-1-one?
N,N-dimethyl-3-(2-propan-2-yl-3-pyridinyl)benzamide;N,N-dimethyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(4-ethyl-2-methylphenyl)-2-propan-2-ylpyridine;N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(3-methylsulfonylphenyl)-2-propan-2-ylpyridine;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]ethanone;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]propan-1-one has a molecular weight of 1798.45 g/mol, XLogP of 26.94, 22 rotatable bonds, 1 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-(2-propan-2-yl-3-pyridinyl)benzamide;N,N-dimethyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(4-ethyl-2-methylphenyl)-2-propan-2-ylpyridine;N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(3-methylsulfonylphenyl)-2-propan-2-ylpyridine;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]ethanone;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]propan-1-one is sourced from PubChem (CID 159258765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).