4-[3-chloro-5-[hydroxy-(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridinyl]-N-(3,4-dimethylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;[5-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-3-pyridinyl]-(5-methyl-1,3,4-oxadiazol-2-yl)methanol;dichloromethane;methane;phenyl N-(3,4-dimethylphenyl)carbamate;hydrochloride

C54H61Cl5N10O7 — CID 159506251

About 4-[3-chloro-5-[hydroxy-(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridinyl]-N-(3,4-dimethylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;[5-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-3-pyridinyl]-(5-methyl-1,3,4-oxadiazol-2-yl)methanol;dichloromethane;methane;phenyl N-(3,4-dimethylphenyl)carbamate;hydrochloride

4-[3-chloro-5-[hydroxy-(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridinyl]-N-(3,4-dimethylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;[5-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-3-pyridinyl]-(5-methyl-1,3,4-oxadiazol-2-yl)methanol;dichloromethane;methane;phenyl N-(3,4-dimethylphenyl)carbamate;hydrochloride (PubChem CID 159506251) has the molecular formula C54H61Cl5N10O7 and a molecular weight of 1139.41 g/mol. Its IUPAC name is 4-[3-chloro-5-[hydroxy-(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridinyl]-N-(3,4-dimethylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;[5-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-3-pyridinyl]-(5-methyl-1,3,4-oxadiazol-2-yl)methanol;dichloromethane;methane;phenyl N-(3,4-dimethylphenyl)carbamate;hydrochloride.

Molecular Properties

• Compound Name: 4-[3-chloro-5-[hydroxy-(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridinyl]-N-(3,4-dimethylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;[5-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-3-pyridinyl]-(5-methyl-1,3,4-oxadiazol-2-yl)methanol;dichloromethane;methane;phenyl N-(3,4-dimethylphenyl)carbamate;hydrochloride
• PubChem CID: 159506251
• Molecular Formula: C54H61Cl5N10O7
• Molecular Weight: 1139.41 g/mol
• Exact Mass: 1136.32
• IUPAC Name: 4-[3-chloro-5-[hydroxy-(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridinyl]-N-(3,4-dimethylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;[5-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-3-pyridinyl]-(5-methyl-1,3,4-oxadiazol-2-yl)methanol;dichloromethane;methane;phenyl N-(3,4-dimethylphenyl)carbamate;hydrochloride
• SMILES: C.Cc1ccc(NC(=O)Oc2ccccc2)cc1C.Cc1nnc(C(O)c2cnc(C3=CCN(C(=O)Nc4ccc(C)c(C)c4)CC3)c(Cl)c2)o1.Cc1nnc(C(O)c2cnc(C3=CCNCC3)c(Cl)c2)o1.Cl.ClCCl
• InChI: InChI=1S/C23H24ClN5O3.C15H15NO2.C14H15ClN4O2.CH2Cl2.CH4.ClH/c1-13-4-5-18(10-14(13)2)26-23(31)29-8-6-16(7-9-29)20-19(24)11-17(12-25-20)21(30)22-28-27-15(3)32-22;1-11-8-9-13(10-12(11)2)16-15(17)18-14-6-4-3-5-7-14;1-8-18-19-14(21-8)13(20)10-6-11(15)12(17-7-10)9-2-4-16-5-3-9;2-1-3;;/h4-6,10-12,21,30H,7-9H2,1-3H3,(H,26,31);3-10H,1-2H3,(H,16,17);2,6-7,13,16,20H,3-5H2,1H3;1H2;1H4;1H
• InChIKey: JSJSTJFCIDWJDX-UHFFFAOYSA-N
• XLogP: 12.72
• TPSA: 226.78 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 14
• Rotatable Bonds: 9
• Heavy Atoms: 76
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1139.41
LogP ≤ 5	12.72
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-[3-chloro-5-[hydroxy-(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridinyl]-N-(3,4-dimethylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;[5-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-3-pyridinyl]-(5-methyl-1,3,4-oxadiazol-2-yl)methanol;dichloromethane;methane;phenyl N-(3,4-dimethylphenyl)carbamate;hydrochloride?

The IUPAC name of 4-[3-chloro-5-[hydroxy-(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridinyl]-N-(3,4-dimethylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;[5-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-3-pyridinyl]-(5-methyl-1,3,4-oxadiazol-2-yl)methanol;dichloromethane;methane;phenyl N-(3,4-dimethylphenyl)carbamate;hydrochloride (CID 159506251) is 4-[3-chloro-5-[hydroxy-(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridinyl]-N-(3,4-dimethylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;[5-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-3-pyridinyl]-(5-methyl-1,3,4-oxadiazol-2-yl)methanol;dichloromethane;methane;phenyl N-(3,4-dimethylphenyl)carbamate;hydrochloride.

What is the SMILES notation for 4-[3-chloro-5-[hydroxy-(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridinyl]-N-(3,4-dimethylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;[5-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-3-pyridinyl]-(5-methyl-1,3,4-oxadiazol-2-yl)methanol;dichloromethane;methane;phenyl N-(3,4-dimethylphenyl)carbamate;hydrochloride?

The canonical SMILES for 4-[3-chloro-5-[hydroxy-(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridinyl]-N-(3,4-dimethylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;[5-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-3-pyridinyl]-(5-methyl-1,3,4-oxadiazol-2-yl)methanol;dichloromethane;methane;phenyl N-(3,4-dimethylphenyl)carbamate;hydrochloride is C.Cc1ccc(NC(=O)Oc2ccccc2)cc1C.Cc1nnc(C(O)c2cnc(C3=CCN(C(=O)Nc4ccc(C)c(C)c4)CC3)c(Cl)c2)o1.Cc1nnc(C(O)c2cnc(C3=CCNCC3)c(Cl)c2)o1.Cl.ClCCl.

What is the InChIKey of 4-[3-chloro-5-[hydroxy-(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridinyl]-N-(3,4-dimethylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;[5-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-3-pyridinyl]-(5-methyl-1,3,4-oxadiazol-2-yl)methanol;dichloromethane;methane;phenyl N-(3,4-dimethylphenyl)carbamate;hydrochloride?

The InChIKey is JSJSTJFCIDWJDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24ClN5O3.C15H15NO2.C14H15ClN4O2.CH2Cl2.CH4.ClH/c1-13-4-5-18(10-14(13)2)26-23(31)29-8-6-16(7-9-29)20-19(24)11-17(12-25-20)21(30)22-28-27-15(3)32-22;1-11-8-9-13(10-12(11)2)16-15(17)18-14-6-4-3-5-7-14;1-8-18-19-14(21-8)13(20)10-6-11(15)12(17-7-10)9-2-4-16-5-3-9;2-1-3;;/h4-6,10-12,21,30H,7-9H2,1-3H3,(H,26,31);3-10H,1-2H3,(H,16,17);2,6-7,13,16,20H,3-5H2,1H3;1H2;1H4;1H.

What are the key properties of 4-[3-chloro-5-[hydroxy-(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridinyl]-N-(3,4-dimethylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;[5-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-3-pyridinyl]-(5-methyl-1,3,4-oxadiazol-2-yl)methanol;dichloromethane;methane;phenyl N-(3,4-dimethylphenyl)carbamate;hydrochloride?

4-[3-chloro-5-[hydroxy-(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridinyl]-N-(3,4-dimethylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;[5-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-3-pyridinyl]-(5-methyl-1,3,4-oxadiazol-2-yl)methanol;dichloromethane;methane;phenyl N-(3,4-dimethylphenyl)carbamate;hydrochloride has a molecular weight of 1139.41 g/mol, XLogP of 12.72, 9 rotatable bonds, 5 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[3-chloro-5-[hydroxy-(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridinyl]-N-(3,4-dimethylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;[5-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-3-pyridinyl]-(5-methyl-1,3,4-oxadiazol-2-yl)methanol;dichloromethane;methane;phenyl N-(3,4-dimethylphenyl)carbamate;hydrochloride is sourced from PubChem (CID 159506251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).