7-chloro-4-[(2S,5S)-2,5-dimethylpiperidin-1-yl]-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidin-2-one;7-chloro-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidine-2,4-dione;2,6-dichloro-5-fluoro-N-[(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)carbamoyl]pyridine-3-carboxamide;2,6-dichloro-5-fluoropyridine-3-carboxamide;(2S,5S)-2,5-dimethylpiperidine;4-methyl-5-pentyl-2-propan-2-ylpyridin-3-amine

C97H128Cl6F4N18O6 — CID 157403875

About 7-chloro-4-[(2S,5S)-2,5-dimethylpiperidin-1-yl]-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidin-2-one;7-chloro-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidine-2,4-dione;2,6-dichloro-5-fluoro-N-[(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)carbamoyl]pyridine-3-carboxamide;2,6-dichloro-5-fluoropyridine-3-carboxamide;(2S,5S)-2,5-dimethylpiperidine;4-methyl-5-pentyl-2-propan-2-ylpyridin-3-amine

7-chloro-4-[(2S,5S)-2,5-dimethylpiperidin-1-yl]-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidin-2-one;7-chloro-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidine-2,4-dione;2,6-dichloro-5-fluoro-N-[(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)carbamoyl]pyridine-3-carboxamide;2,6-dichloro-5-fluoropyridine-3-carboxamide;(2S,5S)-2,5-dimethylpiperidine;4-methyl-5-pentyl-2-propan-2-ylpyridin-3-amine (PubChem CID 157403875) has the molecular formula C97H128Cl6F4N18O6 and a molecular weight of 1930.92 g/mol. Its IUPAC name is 7-chloro-4-[(2S,5S)-2,5-dimethylpiperidin-1-yl]-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidin-2-one;7-chloro-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidine-2,4-dione;2,6-dichloro-5-fluoro-N-[(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)carbamoyl]pyridine-3-carboxamide;2,6-dichloro-5-fluoropyridine-3-carboxamide;(2S,5S)-2,5-dimethylpiperidine;4-methyl-5-pentyl-2-propan-2-ylpyridin-3-amine.

Molecular Properties

• Compound Name: 7-chloro-4-[(2S,5S)-2,5-dimethylpiperidin-1-yl]-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidin-2-one;7-chloro-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidine-2,4-dione;2,6-dichloro-5-fluoro-N-[(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)carbamoyl]pyridine-3-carboxamide;2,6-dichloro-5-fluoropyridine-3-carboxamide;(2S,5S)-2,5-dimethylpiperidine;4-methyl-5-pentyl-2-propan-2-ylpyridin-3-amine
• PubChem CID: 157403875
• Molecular Formula: C97H128Cl6F4N18O6
• Molecular Weight: 1930.92 g/mol
• Exact Mass: 1926.83
• IUPAC Name: 7-chloro-4-[(2S,5S)-2,5-dimethylpiperidin-1-yl]-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidin-2-one;7-chloro-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidine-2,4-dione;2,6-dichloro-5-fluoro-N-[(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)carbamoyl]pyridine-3-carboxamide;2,6-dichloro-5-fluoropyridine-3-carboxamide;(2S,5S)-2,5-dimethylpiperidine;4-methyl-5-pentyl-2-propan-2-ylpyridin-3-amine
• SMILES: CCCCCc1cnc(C(C)C)c(-n2c(=O)[nH]c(=O)c3cc(F)c(Cl)nc32)c1C.CCCCCc1cnc(C(C)C)c(-n2c(=O)nc(N3C[C@@H](C)CC[C@@H]3C)c3cc(F)c(Cl)nc32)c1C.CCCCCc1cnc(C(C)C)c(N)c1C.CCCCCc1cnc(C(C)C)c(NC(=O)NC(=O)c2cc(F)c(Cl)nc2Cl)c1C.C[C@H]1CC[C@H](C)NC1.NC(=O)c1cc(F)c(Cl)nc1Cl
• InChI: InChI=1S/C28H37ClFN5O.C21H25Cl2FN4O2.C21H24ClFN4O2.C14H24N2.C7H15N.C6H3Cl2FN2O/c1-7-8-9-10-20-14-31-23(16(2)3)24(19(20)6)35-27-21(13-22(30)25(29)32-27)26(33-28(35)36)34-15-17(4)11-12-18(34)5;1-5-6-7-8-13-10-25-16(11(2)3)17(12(13)4)26-21(30)28-20(29)14-9-15(24)19(23)27-18(14)22;1-5-6-7-8-13-10-24-16(11(2)3)17(12(13)4)27-19-14(20(28)26-21(27)29)9-15(23)18(22)25-19;1-5-6-7-8-12-9-16-14(10(2)3)13(15)11(12)4;1-6-3-4-7(2)8-5-6;7-4-2(6(10)12)1-3(9)5(8)11-4/h13-14,16-18H,7-12,15H2,1-6H3;9-11H,5-8H2,1-4H3,(H2,26,28,29,30);9-11H,5-8H2,1-4H3,(H,26,28,29);9-10H,5-8,15H2,1-4H3;6-8H,3-5H2,1-2H3;1H,(H2,10,12)/t17-,18-;;;;6-,7-;/m0...0./s1
• InChIKey: BNMJJDKVCVLBIF-IARWXDHGSA-N
• XLogP: 24.08
• TPSA: 335.45 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 20
• Rotatable Bonds: 26
• Heavy Atoms: 131
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1930.92
LogP ≤ 5	24.08
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7-chloro-4-[(2S,5S)-2,5-dimethylpiperidin-1-yl]-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidin-2-one;7-chloro-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidine-2,4-dione;2,6-dichloro-5-fluoro-N-[(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)carbamoyl]pyridine-3-carboxamide;2,6-dichloro-5-fluoropyridine-3-carboxamide;(2S,5S)-2,5-dimethylpiperidine;4-methyl-5-pentyl-2-propan-2-ylpyridin-3-amine?

The IUPAC name of 7-chloro-4-[(2S,5S)-2,5-dimethylpiperidin-1-yl]-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidin-2-one;7-chloro-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidine-2,4-dione;2,6-dichloro-5-fluoro-N-[(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)carbamoyl]pyridine-3-carboxamide;2,6-dichloro-5-fluoropyridine-3-carboxamide;(2S,5S)-2,5-dimethylpiperidine;4-methyl-5-pentyl-2-propan-2-ylpyridin-3-amine (CID 157403875) is 7-chloro-4-[(2S,5S)-2,5-dimethylpiperidin-1-yl]-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidin-2-one;7-chloro-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidine-2,4-dione;2,6-dichloro-5-fluoro-N-[(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)carbamoyl]pyridine-3-carboxamide;2,6-dichloro-5-fluoropyridine-3-carboxamide;(2S,5S)-2,5-dimethylpiperidine;4-methyl-5-pentyl-2-propan-2-ylpyridin-3-amine.

What is the SMILES notation for 7-chloro-4-[(2S,5S)-2,5-dimethylpiperidin-1-yl]-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidin-2-one;7-chloro-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidine-2,4-dione;2,6-dichloro-5-fluoro-N-[(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)carbamoyl]pyridine-3-carboxamide;2,6-dichloro-5-fluoropyridine-3-carboxamide;(2S,5S)-2,5-dimethylpiperidine;4-methyl-5-pentyl-2-propan-2-ylpyridin-3-amine?

The canonical SMILES for 7-chloro-4-[(2S,5S)-2,5-dimethylpiperidin-1-yl]-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidin-2-one;7-chloro-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidine-2,4-dione;2,6-dichloro-5-fluoro-N-[(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)carbamoyl]pyridine-3-carboxamide;2,6-dichloro-5-fluoropyridine-3-carboxamide;(2S,5S)-2,5-dimethylpiperidine;4-methyl-5-pentyl-2-propan-2-ylpyridin-3-amine is CCCCCc1cnc(C(C)C)c(-n2c(=O)[nH]c(=O)c3cc(F)c(Cl)nc32)c1C.CCCCCc1cnc(C(C)C)c(-n2c(=O)nc(N3C[C@@H](C)CC[C@@H]3C)c3cc(F)c(Cl)nc32)c1C.CCCCCc1cnc(C(C)C)c(N)c1C.CCCCCc1cnc(C(C)C)c(NC(=O)NC(=O)c2cc(F)c(Cl)nc2Cl)c1C.C[C@H]1CC[C@H](C)NC1.NC(=O)c1cc(F)c(Cl)nc1Cl.

What is the InChIKey of 7-chloro-4-[(2S,5S)-2,5-dimethylpiperidin-1-yl]-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidin-2-one;7-chloro-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidine-2,4-dione;2,6-dichloro-5-fluoro-N-[(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)carbamoyl]pyridine-3-carboxamide;2,6-dichloro-5-fluoropyridine-3-carboxamide;(2S,5S)-2,5-dimethylpiperidine;4-methyl-5-pentyl-2-propan-2-ylpyridin-3-amine?

The InChIKey is BNMJJDKVCVLBIF-IARWXDHGSA-N. The full InChI is InChI=1S/C28H37ClFN5O.C21H25Cl2FN4O2.C21H24ClFN4O2.C14H24N2.C7H15N.C6H3Cl2FN2O/c1-7-8-9-10-20-14-31-23(16(2)3)24(19(20)6)35-27-21(13-22(30)25(29)32-27)26(33-28(35)36)34-15-17(4)11-12-18(34)5;1-5-6-7-8-13-10-25-16(11(2)3)17(12(13)4)26-21(30)28-20(29)14-9-15(24)19(23)27-18(14)22;1-5-6-7-8-13-10-24-16(11(2)3)17(12(13)4)27-19-14(20(28)26-21(27)29)9-15(23)18(22)25-19;1-5-6-7-8-12-9-16-14(10(2)3)13(15)11(12)4;1-6-3-4-7(2)8-5-6;7-4-2(6(10)12)1-3(9)5(8)11-4/h13-14,16-18H,7-12,15H2,1-6H3;9-11H,5-8H2,1-4H3,(H2,26,28,29,30);9-11H,5-8H2,1-4H3,(H,26,28,29);9-10H,5-8,15H2,1-4H3;6-8H,3-5H2,1-2H3;1H,(H2,10,12)/t17-,18-;;;;6-,7-;/m0...0./s1.

What are the key properties of 7-chloro-4-[(2S,5S)-2,5-dimethylpiperidin-1-yl]-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidin-2-one;7-chloro-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidine-2,4-dione;2,6-dichloro-5-fluoro-N-[(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)carbamoyl]pyridine-3-carboxamide;2,6-dichloro-5-fluoropyridine-3-carboxamide;(2S,5S)-2,5-dimethylpiperidine;4-methyl-5-pentyl-2-propan-2-ylpyridin-3-amine?

7-chloro-4-[(2S,5S)-2,5-dimethylpiperidin-1-yl]-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidin-2-one;7-chloro-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidine-2,4-dione;2,6-dichloro-5-fluoro-N-[(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)carbamoyl]pyridine-3-carboxamide;2,6-dichloro-5-fluoropyridine-3-carboxamide;(2S,5S)-2,5-dimethylpiperidine;4-methyl-5-pentyl-2-propan-2-ylpyridin-3-amine has a molecular weight of 1930.92 g/mol, XLogP of 24.08, 26 rotatable bonds, 6 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 7-chloro-4-[(2S,5S)-2,5-dimethylpiperidin-1-yl]-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidin-2-one;7-chloro-6-fluoro-1-(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidine-2,4-dione;2,6-dichloro-5-fluoro-N-[(4-methyl-5-pentyl-2-propan-2-yl-3-pyridinyl)carbamoyl]pyridine-3-carboxamide;2,6-dichloro-5-fluoropyridine-3-carboxamide;(2S,5S)-2,5-dimethylpiperidine;4-methyl-5-pentyl-2-propan-2-ylpyridin-3-amine is sourced from PubChem (CID 157403875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).