tert-butyl N-[3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]-4-pyridinyl]carbamate;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridin-4-amine;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridine-4-carboxylic acid;(3S)-4-(5-chloro-6-fluoro-2-pyridinyl)-3-methylmorpholine;2,6-difluoropyridine;(3S)-4-(6-fluoro-2-pyridinyl)-3-methylmorpholine;(3S)-3-methylmorpholine

C66H85Cl4F7N14O10 — CID 158151285

About tert-butyl N-[3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]-4-pyridinyl]carbamate;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridin-4-amine;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridine-4-carboxylic acid;(3S)-4-(5-chloro-6-fluoro-2-pyridinyl)-3-methylmorpholine;2,6-difluoropyridine;(3S)-4-(6-fluoro-2-pyridinyl)-3-methylmorpholine;(3S)-3-methylmorpholine

tert-butyl N-[3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]-4-pyridinyl]carbamate;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridin-4-amine;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridine-4-carboxylic acid;(3S)-4-(5-chloro-6-fluoro-2-pyridinyl)-3-methylmorpholine;2,6-difluoropyridine;(3S)-4-(6-fluoro-2-pyridinyl)-3-methylmorpholine;(3S)-3-methylmorpholine (PubChem CID 158151285) has the molecular formula C66H85Cl4F7N14O10 and a molecular weight of 1509.29 g/mol. Its IUPAC name is tert-butyl N-[3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]-4-pyridinyl]carbamate;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridin-4-amine;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridine-4-carboxylic acid;(3S)-4-(5-chloro-6-fluoro-2-pyridinyl)-3-methylmorpholine;2,6-difluoropyridine;(3S)-4-(6-fluoro-2-pyridinyl)-3-methylmorpholine;(3S)-3-methylmorpholine.

Molecular Properties

• Compound Name: tert-butyl N-[3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]-4-pyridinyl]carbamate;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridin-4-amine;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridine-4-carboxylic acid;(3S)-4-(5-chloro-6-fluoro-2-pyridinyl)-3-methylmorpholine;2,6-difluoropyridine;(3S)-4-(6-fluoro-2-pyridinyl)-3-methylmorpholine;(3S)-3-methylmorpholine
• PubChem CID: 158151285
• Molecular Formula: C66H85Cl4F7N14O10
• Molecular Weight: 1509.29 g/mol
• Exact Mass: 1506.52
• IUPAC Name: tert-butyl N-[3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]-4-pyridinyl]carbamate;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridin-4-amine;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridine-4-carboxylic acid;(3S)-4-(5-chloro-6-fluoro-2-pyridinyl)-3-methylmorpholine;2,6-difluoropyridine;(3S)-4-(6-fluoro-2-pyridinyl)-3-methylmorpholine;(3S)-3-methylmorpholine
• SMILES: C[C@H]1COCCN1.C[C@H]1COCCN1c1cc(C(=O)O)c(Cl)c(F)n1.C[C@H]1COCCN1c1cc(N)c(Cl)c(F)n1.C[C@H]1COCCN1c1cc(NC(=O)OC(C)(C)C)c(Cl)c(F)n1.C[C@H]1COCCN1c1ccc(Cl)c(F)n1.C[C@H]1COCCN1c1cccc(F)n1.Fc1cccc(F)n1
• InChI: InChI=1S/C15H21ClFN3O3.C11H12ClFN2O3.C10H13ClFN3O.C10H12ClFN2O.C10H13FN2O.C5H3F2N.C5H11NO/c1-9-8-22-6-5-20(9)11-7-10(12(16)13(17)19-11)18-14(21)23-15(2,3)4;1-6-5-18-3-2-15(6)8-4-7(11(16)17)9(12)10(13)14-8;1-6-5-16-3-2-15(6)8-4-7(13)9(11)10(12)14-8;1-7-6-15-5-4-14(7)9-3-2-8(11)10(12)13-9;1-8-7-14-6-5-13(8)10-4-2-3-9(11)12-10;6-4-2-1-3-5(7)8-4;1-5-4-7-3-2-6-5/h7,9H,5-6,8H2,1-4H3,(H,18,19,21);4,6H,2-3,5H2,1H3,(H,16,17);4,6H,2-3,5H2,1H3,(H2,13,14);2-3,7H,4-6H2,1H3;2-4,8H,5-7H2,1H3;1-3H;5-6H,2-4H2,1H3/t9-;2*6-;7-;8-;;5-/m00000.0/s1
• InChIKey: FVDHEDAOTBEAHF-QMAXSQEGSA-N
• XLogP: 11.82
• TPSA: 262.60 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 22
• Rotatable Bonds: 7
• Heavy Atoms: 101
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1509.29
LogP ≤ 5	11.82
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]-4-pyridinyl]carbamate;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridin-4-amine;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridine-4-carboxylic acid;(3S)-4-(5-chloro-6-fluoro-2-pyridinyl)-3-methylmorpholine;2,6-difluoropyridine;(3S)-4-(6-fluoro-2-pyridinyl)-3-methylmorpholine;(3S)-3-methylmorpholine?

The IUPAC name of tert-butyl N-[3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]-4-pyridinyl]carbamate;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridin-4-amine;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridine-4-carboxylic acid;(3S)-4-(5-chloro-6-fluoro-2-pyridinyl)-3-methylmorpholine;2,6-difluoropyridine;(3S)-4-(6-fluoro-2-pyridinyl)-3-methylmorpholine;(3S)-3-methylmorpholine (CID 158151285) is tert-butyl N-[3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]-4-pyridinyl]carbamate;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridin-4-amine;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridine-4-carboxylic acid;(3S)-4-(5-chloro-6-fluoro-2-pyridinyl)-3-methylmorpholine;2,6-difluoropyridine;(3S)-4-(6-fluoro-2-pyridinyl)-3-methylmorpholine;(3S)-3-methylmorpholine.

What is the SMILES notation for tert-butyl N-[3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]-4-pyridinyl]carbamate;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridin-4-amine;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridine-4-carboxylic acid;(3S)-4-(5-chloro-6-fluoro-2-pyridinyl)-3-methylmorpholine;2,6-difluoropyridine;(3S)-4-(6-fluoro-2-pyridinyl)-3-methylmorpholine;(3S)-3-methylmorpholine?

The canonical SMILES for tert-butyl N-[3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]-4-pyridinyl]carbamate;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridin-4-amine;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridine-4-carboxylic acid;(3S)-4-(5-chloro-6-fluoro-2-pyridinyl)-3-methylmorpholine;2,6-difluoropyridine;(3S)-4-(6-fluoro-2-pyridinyl)-3-methylmorpholine;(3S)-3-methylmorpholine is C[C@H]1COCCN1.C[C@H]1COCCN1c1cc(C(=O)O)c(Cl)c(F)n1.C[C@H]1COCCN1c1cc(N)c(Cl)c(F)n1.C[C@H]1COCCN1c1cc(NC(=O)OC(C)(C)C)c(Cl)c(F)n1.C[C@H]1COCCN1c1ccc(Cl)c(F)n1.C[C@H]1COCCN1c1cccc(F)n1.Fc1cccc(F)n1.

What is the InChIKey of tert-butyl N-[3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]-4-pyridinyl]carbamate;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridin-4-amine;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridine-4-carboxylic acid;(3S)-4-(5-chloro-6-fluoro-2-pyridinyl)-3-methylmorpholine;2,6-difluoropyridine;(3S)-4-(6-fluoro-2-pyridinyl)-3-methylmorpholine;(3S)-3-methylmorpholine?

The InChIKey is FVDHEDAOTBEAHF-QMAXSQEGSA-N. The full InChI is InChI=1S/C15H21ClFN3O3.C11H12ClFN2O3.C10H13ClFN3O.C10H12ClFN2O.C10H13FN2O.C5H3F2N.C5H11NO/c1-9-8-22-6-5-20(9)11-7-10(12(16)13(17)19-11)18-14(21)23-15(2,3)4;1-6-5-18-3-2-15(6)8-4-7(11(16)17)9(12)10(13)14-8;1-6-5-16-3-2-15(6)8-4-7(13)9(11)10(12)14-8;1-7-6-15-5-4-14(7)9-3-2-8(11)10(12)13-9;1-8-7-14-6-5-13(8)10-4-2-3-9(11)12-10;6-4-2-1-3-5(7)8-4;1-5-4-7-3-2-6-5/h7,9H,5-6,8H2,1-4H3,(H,18,19,21);4,6H,2-3,5H2,1H3,(H,16,17);4,6H,2-3,5H2,1H3,(H2,13,14);2-3,7H,4-6H2,1H3;2-4,8H,5-7H2,1H3;1-3H;5-6H,2-4H2,1H3/t9-;2*6-;7-;8-;;5-/m00000.0/s1.

What are the key properties of tert-butyl N-[3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]-4-pyridinyl]carbamate;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridin-4-amine;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridine-4-carboxylic acid;(3S)-4-(5-chloro-6-fluoro-2-pyridinyl)-3-methylmorpholine;2,6-difluoropyridine;(3S)-4-(6-fluoro-2-pyridinyl)-3-methylmorpholine;(3S)-3-methylmorpholine?

tert-butyl N-[3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]-4-pyridinyl]carbamate;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridin-4-amine;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridine-4-carboxylic acid;(3S)-4-(5-chloro-6-fluoro-2-pyridinyl)-3-methylmorpholine;2,6-difluoropyridine;(3S)-4-(6-fluoro-2-pyridinyl)-3-methylmorpholine;(3S)-3-methylmorpholine has a molecular weight of 1509.29 g/mol, XLogP of 11.82, 7 rotatable bonds, 4 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl N-[3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]-4-pyridinyl]carbamate;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridin-4-amine;3-chloro-2-fluoro-6-[(3S)-3-methylmorpholin-4-yl]pyridine-4-carboxylic acid;(3S)-4-(5-chloro-6-fluoro-2-pyridinyl)-3-methylmorpholine;2,6-difluoropyridine;(3S)-4-(6-fluoro-2-pyridinyl)-3-methylmorpholine;(3S)-3-methylmorpholine is sourced from PubChem (CID 158151285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).