5-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(morpholine-4-carbonyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(3H-pyrrol-5-yl)ethylamino]pyridine-3-carboxamide

C88H76Cl5N19O7 — CID 157235565

IUPAC5-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(morpholine-4-carbonyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(3H-pyrrol-5-yl)ethylamino]pyridine-3-carboxamide
SMILESO=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(-n2cccn2)nc1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(C(=O)N2CCOCC2)nc1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(NCCC2=CCC=N2)nc1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1cnc(NCCN2CCOCC2)c(Cl)c1
InChIInChI=1S/C23H23Cl2N5O2.C23H20ClN5O.C22H19ClN4O3.C20H14ClN5O/c24-19-5-4-17(14-18(19)21-3-1-2-6-26-21)29-23(31)16-13-20(25)22(28-15-16)27-7-8-30-9-11-32-12-10-30;24-20-8-7-18(14-19(20)21-5-1-2-11-26-21)29-23(30)16-6-9-22(28-15-16)27-13-10-17-4-3-12-25-17;23-18-6-5-16(13-17(18)19-3-1-2-8-24-19)26-21(28)15-4-7-20(25-14-15)22(29)27-9-11-30-12-10-27;21-17-7-6-15(12-16(17)18-4-1-2-9-22-18)25-20(27)14-5-8-19(23-13-14)26-11-3-10-24-26/h1-6,13-15H,7-12H2,(H,27,28)(H,29,31);1-2,4-9,11-12,14-15H,3,10,13H2,(H,27,28)(H,29,30);1-8,13-14H,9-12H2,(H,26,28);1-13H,(H,25,27)
InChIKeyAUPBQAZWSUDFMN-UHFFFAOYSA-N
MW1688.97 g/mol
LogP17.41
Rot. Bonds22

About 5-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(morpholine-4-carbonyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(3H-pyrrol-5-yl)ethylamino]pyridine-3-carboxamide

5-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(morpholine-4-carbonyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(3H-pyrrol-5-yl)ethylamino]pyridine-3-carboxamide (PubChem CID 157235565) has the molecular formula C88H76Cl5N19O7 and a molecular weight of 1688.97 g/mol. Its IUPAC name is 5-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(morpholine-4-carbonyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(3H-pyrrol-5-yl)ethylamino]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(morpholine-4-carbonyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(3H-pyrrol-5-yl)ethylamino]pyridine-3-carboxamide
PubChem CID157235565
Molecular FormulaC88H76Cl5N19O7
Molecular Weight1688.97 g/mol
Exact Mass1685.46
IUPAC Name5-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(morpholine-4-carbonyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(3H-pyrrol-5-yl)ethylamino]pyridine-3-carboxamide
SMILESO=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(-n2cccn2)nc1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(C(=O)N2CCOCC2)nc1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(NCCC2=CCC=N2)nc1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1cnc(NCCN2CCOCC2)c(Cl)c1
InChIInChI=1S/C23H23Cl2N5O2.C23H20ClN5O.C22H19ClN4O3.C20H14ClN5O/c24-19-5-4-17(14-18(19)21-3-1-2-6-26-21)29-23(31)16-13-20(25)22(28-15-16)27-7-8-30-9-11-32-12-10-30;24-20-8-7-18(14-19(20)21-5-1-2-11-26-21)29-23(30)16-6-9-22(28-15-16)27-13-10-17-4-3-12-25-17;23-18-6-5-16(13-17(18)19-3-1-2-8-24-19)26-21(28)15-4-7-20(25-14-15)22(29)27-9-11-30-12-10-27;21-17-7-6-15(12-16(17)18-4-1-2-9-22-18)25-20(27)14-5-8-19(23-13-14)26-11-3-10-24-26/h1-6,13-15H,7-12H2,(H,27,28)(H,29,31);1-2,4-9,11-12,14-15H,3,10,13H2,(H,27,28)(H,29,30);1-8,13-14H,9-12H2,(H,26,28);1-13H,(H,25,27)
InChIKeyAUPBQAZWSUDFMN-UHFFFAOYSA-N
XLogP17.41
TPSA315.77 Ų
H-Bond Donors6
H-Bond Acceptors21
Rotatable Bonds22
Heavy Atoms119
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001688.97
LogP ≤ 517.41
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1021

Analyze 5-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(morpholine-4-carbonyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(3H-pyrrol-5-yl)ethylamino]pyridine-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(morpholine-4-carbonyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(3H-pyrrol-5-yl)ethylamino]pyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(morpholine-4-carbonyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(3H-pyrrol-5-yl)ethylamino]pyridine-3-carboxamide (CID 157235565) is 5-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(morpholine-4-carbonyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(3H-pyrrol-5-yl)ethylamino]pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(morpholine-4-carbonyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(3H-pyrrol-5-yl)ethylamino]pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(morpholine-4-carbonyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(3H-pyrrol-5-yl)ethylamino]pyridine-3-carboxamide is O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(-n2cccn2)nc1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(C(=O)N2CCOCC2)nc1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(NCCC2=CCC=N2)nc1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1cnc(NCCN2CCOCC2)c(Cl)c1.
What is the InChIKey of 5-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(morpholine-4-carbonyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(3H-pyrrol-5-yl)ethylamino]pyridine-3-carboxamide?
The InChIKey is AUPBQAZWSUDFMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23Cl2N5O2.C23H20ClN5O.C22H19ClN4O3.C20H14ClN5O/c24-19-5-4-17(14-18(19)21-3-1-2-6-26-21)29-23(31)16-13-20(25)22(28-15-16)27-7-8-30-9-11-32-12-10-30;24-20-8-7-18(14-19(20)21-5-1-2-11-26-21)29-23(30)16-6-9-22(28-15-16)27-13-10-17-4-3-12-25-17;23-18-6-5-16(13-17(18)19-3-1-2-8-24-19)26-21(28)15-4-7-20(25-14-15)22(29)27-9-11-30-12-10-27;21-17-7-6-15(12-16(17)18-4-1-2-9-22-18)25-20(27)14-5-8-19(23-13-14)26-11-3-10-24-26/h1-6,13-15H,7-12H2,(H,27,28)(H,29,31);1-2,4-9,11-12,14-15H,3,10,13H2,(H,27,28)(H,29,30);1-8,13-14H,9-12H2,(H,26,28);1-13H,(H,25,27).
What are the key properties of 5-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(morpholine-4-carbonyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(3H-pyrrol-5-yl)ethylamino]pyridine-3-carboxamide?
5-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(morpholine-4-carbonyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(3H-pyrrol-5-yl)ethylamino]pyridine-3-carboxamide has a molecular weight of 1688.97 g/mol, XLogP of 17.41, 22 rotatable bonds, 6 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(morpholine-4-carbonyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(3H-pyrrol-5-yl)ethylamino]pyridine-3-carboxamide is sourced from PubChem (CID 157235565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).