2-chloro-N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-6-fluorobenzamide;1-(2-chloro-6-methylphenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2-fluorophenyl)ethanone;1-(2,6-difluorophenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2,5-dimethylphenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]-2-pyridinyl]ethanone

C107H105Cl4F4N29O5 — CID 160841719

IUPAC2-chloro-N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-6-fluorobenzamide;1-(2-chloro-6-methylphenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2-fluorophenyl)ethanone;1-(2,6-difluorophenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2,5-dimethylphenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]-2-pyridinyl]ethanone
SMILESCC1=C(c2ccc(CC(=O)c3c(C)cccc3Cl)cc2)CN(c2nnn(C)n2)CC1.CC1=C(c2ccc(CC(=O)c3cc(C)ccc3C)nc2)CN(c2nnn(C)n2)CC1.CC1=C(c2cnc(CC(=O)c3c(F)cccc3F)cn2)CN(c2nnn(C)n2)CC1.Cn1nnc(N2CCC(Cl)=C(c3ccc(CC(=O)c4ccccc4F)cc3)C2)n1.Cn1nnc(N2CCC(Cl)=C(c3ccc(NC(=O)c4c(F)cccc4Cl)cc3)C2)n1
InChIInChI=1S/C23H24ClN5O.C23H26N6O.C21H19ClFN5O.C20H17Cl2FN6O.C20H19F2N7O/c1-15-11-12-29(23-25-27-28(3)26-23)14-19(15)18-9-7-17(8-10-18)13-21(30)22-16(2)5-4-6-20(22)24;1-15-5-6-16(2)20(11-15)22(30)12-19-8-7-18(13-24-19)21-14-29(10-9-17(21)3)23-25-27-28(4)26-23;1-27-25-21(24-26-27)28-11-10-18(22)17(13-28)15-8-6-14(7-9-15)12-20(29)16-4-2-3-5-19(16)23;1-28-26-20(25-27-28)29-10-9-15(21)14(11-29)12-5-7-13(8-6-12)24-19(30)18-16(22)3-2-4-17(18)23;1-12-6-7-29(20-25-27-28(2)26-20)11-14(12)17-10-23-13(9-24-17)8-18(30)19-15(21)4-3-5-16(19)22/h4-10H,11-14H2,1-3H3;5-8,11,13H,9-10,12,14H2,1-4H3;2-9H,10-13H2,1H3;2-8H,9-11H2,1H3,(H,24,30);3-5,9-10H,6-8,11H2,1-2H3
InChIKeySICWYQQZHULFHT-UHFFFAOYSA-N
MW2095.02 g/mol
LogP17.75
Rot. Bonds24

About 2-chloro-N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-6-fluorobenzamide;1-(2-chloro-6-methylphenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2-fluorophenyl)ethanone;1-(2,6-difluorophenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2,5-dimethylphenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]-2-pyridinyl]ethanone

2-chloro-N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-6-fluorobenzamide;1-(2-chloro-6-methylphenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2-fluorophenyl)ethanone;1-(2,6-difluorophenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2,5-dimethylphenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]-2-pyridinyl]ethanone (PubChem CID 160841719) has the molecular formula C107H105Cl4F4N29O5 and a molecular weight of 2095.02 g/mol. Its IUPAC name is 2-chloro-N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-6-fluorobenzamide;1-(2-chloro-6-methylphenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2-fluorophenyl)ethanone;1-(2,6-difluorophenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2,5-dimethylphenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]-2-pyridinyl]ethanone.

Molecular Properties

Compound Name2-chloro-N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-6-fluorobenzamide;1-(2-chloro-6-methylphenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2-fluorophenyl)ethanone;1-(2,6-difluorophenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2,5-dimethylphenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]-2-pyridinyl]ethanone
PubChem CID160841719
Molecular FormulaC107H105Cl4F4N29O5
Molecular Weight2095.02 g/mol
Exact Mass2091.75
IUPAC Name2-chloro-N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-6-fluorobenzamide;1-(2-chloro-6-methylphenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2-fluorophenyl)ethanone;1-(2,6-difluorophenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2,5-dimethylphenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]-2-pyridinyl]ethanone
SMILESCC1=C(c2ccc(CC(=O)c3c(C)cccc3Cl)cc2)CN(c2nnn(C)n2)CC1.CC1=C(c2ccc(CC(=O)c3cc(C)ccc3C)nc2)CN(c2nnn(C)n2)CC1.CC1=C(c2cnc(CC(=O)c3c(F)cccc3F)cn2)CN(c2nnn(C)n2)CC1.Cn1nnc(N2CCC(Cl)=C(c3ccc(CC(=O)c4ccccc4F)cc3)C2)n1.Cn1nnc(N2CCC(Cl)=C(c3ccc(NC(=O)c4c(F)cccc4Cl)cc3)C2)n1
InChIInChI=1S/C23H24ClN5O.C23H26N6O.C21H19ClFN5O.C20H17Cl2FN6O.C20H19F2N7O/c1-15-11-12-29(23-25-27-28(3)26-23)14-19(15)18-9-7-17(8-10-18)13-21(30)22-16(2)5-4-6-20(22)24;1-15-5-6-16(2)20(11-15)22(30)12-19-8-7-18(13-24-19)21-14-29(10-9-17(21)3)23-25-27-28(4)26-23;1-27-25-21(24-26-27)28-11-10-18(22)17(13-28)15-8-6-14(7-9-15)12-20(29)16-4-2-3-5-19(16)23;1-28-26-20(25-27-28)29-10-9-15(21)14(11-29)12-5-7-13(8-6-12)24-19(30)18-16(22)3-2-4-17(18)23;1-12-6-7-29(20-25-27-28(2)26-20)11-14(12)17-10-23-13(9-24-17)8-18(30)19-15(21)4-3-5-16(19)22/h4-10H,11-14H2,1-3H3;5-8,11,13H,9-10,12,14H2,1-4H3;2-9H,10-13H2,1H3;2-8H,9-11H2,1H3,(H,24,30);3-5,9-10H,6-8,11H2,1-2H3
InChIKeySICWYQQZHULFHT-UHFFFAOYSA-N
XLogP17.75
TPSA370.25 Ų
H-Bond Donors1
H-Bond Acceptors33
Rotatable Bonds24
Heavy Atoms149
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002095.02
LogP ≤ 517.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1033

Analyze 2-chloro-N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-6-fluorobenzamide;1-(2-chloro-6-methylphenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2-fluorophenyl)ethanone;1-(2,6-difluorophenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2,5-dimethylphenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]-2-pyridinyl]ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-6-fluorobenzamide;1-(2-chloro-6-methylphenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2-fluorophenyl)ethanone;1-(2,6-difluorophenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2,5-dimethylphenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]-2-pyridinyl]ethanone?
The IUPAC name of 2-chloro-N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-6-fluorobenzamide;1-(2-chloro-6-methylphenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2-fluorophenyl)ethanone;1-(2,6-difluorophenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2,5-dimethylphenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]-2-pyridinyl]ethanone (CID 160841719) is 2-chloro-N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-6-fluorobenzamide;1-(2-chloro-6-methylphenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2-fluorophenyl)ethanone;1-(2,6-difluorophenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2,5-dimethylphenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]-2-pyridinyl]ethanone.
What is the SMILES notation for 2-chloro-N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-6-fluorobenzamide;1-(2-chloro-6-methylphenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2-fluorophenyl)ethanone;1-(2,6-difluorophenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2,5-dimethylphenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]-2-pyridinyl]ethanone?
The canonical SMILES for 2-chloro-N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-6-fluorobenzamide;1-(2-chloro-6-methylphenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2-fluorophenyl)ethanone;1-(2,6-difluorophenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2,5-dimethylphenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]-2-pyridinyl]ethanone is CC1=C(c2ccc(CC(=O)c3c(C)cccc3Cl)cc2)CN(c2nnn(C)n2)CC1.CC1=C(c2ccc(CC(=O)c3cc(C)ccc3C)nc2)CN(c2nnn(C)n2)CC1.CC1=C(c2cnc(CC(=O)c3c(F)cccc3F)cn2)CN(c2nnn(C)n2)CC1.Cn1nnc(N2CCC(Cl)=C(c3ccc(CC(=O)c4ccccc4F)cc3)C2)n1.Cn1nnc(N2CCC(Cl)=C(c3ccc(NC(=O)c4c(F)cccc4Cl)cc3)C2)n1.
What is the InChIKey of 2-chloro-N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-6-fluorobenzamide;1-(2-chloro-6-methylphenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2-fluorophenyl)ethanone;1-(2,6-difluorophenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2,5-dimethylphenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]-2-pyridinyl]ethanone?
The InChIKey is SICWYQQZHULFHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24ClN5O.C23H26N6O.C21H19ClFN5O.C20H17Cl2FN6O.C20H19F2N7O/c1-15-11-12-29(23-25-27-28(3)26-23)14-19(15)18-9-7-17(8-10-18)13-21(30)22-16(2)5-4-6-20(22)24;1-15-5-6-16(2)20(11-15)22(30)12-19-8-7-18(13-24-19)21-14-29(10-9-17(21)3)23-25-27-28(4)26-23;1-27-25-21(24-26-27)28-11-10-18(22)17(13-28)15-8-6-14(7-9-15)12-20(29)16-4-2-3-5-19(16)23;1-28-26-20(25-27-28)29-10-9-15(21)14(11-29)12-5-7-13(8-6-12)24-19(30)18-16(22)3-2-4-17(18)23;1-12-6-7-29(20-25-27-28(2)26-20)11-14(12)17-10-23-13(9-24-17)8-18(30)19-15(21)4-3-5-16(19)22/h4-10H,11-14H2,1-3H3;5-8,11,13H,9-10,12,14H2,1-4H3;2-9H,10-13H2,1H3;2-8H,9-11H2,1H3,(H,24,30);3-5,9-10H,6-8,11H2,1-2H3.
What are the key properties of 2-chloro-N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-6-fluorobenzamide;1-(2-chloro-6-methylphenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2-fluorophenyl)ethanone;1-(2,6-difluorophenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2,5-dimethylphenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]-2-pyridinyl]ethanone?
2-chloro-N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-6-fluorobenzamide;1-(2-chloro-6-methylphenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2-fluorophenyl)ethanone;1-(2,6-difluorophenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2,5-dimethylphenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]-2-pyridinyl]ethanone has a molecular weight of 2095.02 g/mol, XLogP of 17.75, 24 rotatable bonds, 1 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-6-fluorobenzamide;1-(2-chloro-6-methylphenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2-fluorophenyl)ethanone;1-(2,6-difluorophenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2,5-dimethylphenyl)-2-[5-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]-2-pyridinyl]ethanone is sourced from PubChem (CID 160841719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).