6-[1'-(3-methoxypropyl)spiro[chromene-2,4'-piperidine]-6-yl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(1'-propylspiro[chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;6-(3-methyl-4-oxo-1'-propan-2-ylspiro[1,3-benzoxazine-2,4'-piperidine]-6-yl)-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide

C109H123N17O13S — CID 160615757

About 6-[1'-(3-methoxypropyl)spiro[chromene-2,4'-piperidine]-6-yl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(1'-propylspiro[chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;6-(3-methyl-4-oxo-1'-propan-2-ylspiro[1,3-benzoxazine-2,4'-piperidine]-6-yl)-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide

6-[1'-(3-methoxypropyl)spiro[chromene-2,4'-piperidine]-6-yl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(1'-propylspiro[chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;6-(3-methyl-4-oxo-1'-propan-2-ylspiro[1,3-benzoxazine-2,4'-piperidine]-6-yl)-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide (PubChem CID 160615757) has the molecular formula C109H123N17O13S and a molecular weight of 1911.36 g/mol. Its IUPAC name is 6-[1'-(3-methoxypropyl)spiro[chromene-2,4'-piperidine]-6-yl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(1'-propylspiro[chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;6-(3-methyl-4-oxo-1'-propan-2-ylspiro[1,3-benzoxazine-2,4'-piperidine]-6-yl)-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: 6-[1'-(3-methoxypropyl)spiro[chromene-2,4'-piperidine]-6-yl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(1'-propylspiro[chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;6-(3-methyl-4-oxo-1'-propan-2-ylspiro[1,3-benzoxazine-2,4'-piperidine]-6-yl)-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide
• PubChem CID: 160615757
• Molecular Formula: C109H123N17O13S
• Molecular Weight: 1911.36 g/mol
• Exact Mass: 1909.92
• IUPAC Name: 6-[1'-(3-methoxypropyl)spiro[chromene-2,4'-piperidine]-6-yl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(1'-propylspiro[chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;6-(3-methyl-4-oxo-1'-propan-2-ylspiro[1,3-benzoxazine-2,4'-piperidine]-6-yl)-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide
• SMILES: CC(C)N1CCC2(CC1)Oc1ccc(-c3ccc(C(=O)NCc4cnn(C)c4)cn3)cc1C(=O)N2C.CCCN1CCC2(C=Cc3cc(-c4ccc(C(=O)NCc5cc(C)no5)cn4)ccc3O2)CC1.CCCN1CCC2(CC1)CC(=O)c1cc(-c3ccc(C(=O)NCc4cc(C)no4)cn3)ccc1O2.COCCCN1CCC2(C=Cc3cc(-c4ccc(C(=O)NCc5cccs5)cn4)ccc3O2)CC1
• InChI: InChI=1S/C28H31N3O3S.C27H32N6O3.C27H30N4O4.C27H30N4O3/c1-33-16-3-13-31-14-11-28(12-15-31)10-9-22-18-21(6-8-26(22)34-28)25-7-5-23(19-29-25)27(32)30-20-24-4-2-17-35-24;1-18(2)33-11-9-27(10-12-33)32(4)26(35)22-13-20(6-8-24(22)36-27)23-7-5-21(16-28-23)25(34)29-14-19-15-30-31(3)17-19;1-3-10-31-11-8-27(9-12-31)15-24(32)22-14-19(5-7-25(22)34-27)23-6-4-20(16-28-23)26(33)29-17-21-13-18(2)30-35-21;1-3-12-31-13-10-27(11-14-31)9-8-21-16-20(5-7-25(21)33-27)24-6-4-22(17-28-24)26(32)29-18-23-15-19(2)30-34-23/h2,4-10,17-19H,3,11-16,20H2,1H3,(H,30,32);5-8,13,15-18H,9-12,14H2,1-4H3,(H,29,34);4-7,13-14,16H,3,8-12,15,17H2,1-2H3,(H,29,33);4-9,15-17H,3,10-14,18H2,1-2H3,(H,29,32)
• InChIKey: RGBJSKZOXWRUHI-UHFFFAOYSA-N
• XLogP: 16.90
• TPSA: 334.33 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 26
• Rotatable Bonds: 25
• Heavy Atoms: 140
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1911.36
LogP ≤ 5	16.90
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 6-[1'-(3-methoxypropyl)spiro[chromene-2,4'-piperidine]-6-yl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(1'-propylspiro[chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;6-(3-methyl-4-oxo-1'-propan-2-ylspiro[1,3-benzoxazine-2,4'-piperidine]-6-yl)-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide?

The IUPAC name of 6-[1'-(3-methoxypropyl)spiro[chromene-2,4'-piperidine]-6-yl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(1'-propylspiro[chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;6-(3-methyl-4-oxo-1'-propan-2-ylspiro[1,3-benzoxazine-2,4'-piperidine]-6-yl)-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide (CID 160615757) is 6-[1'-(3-methoxypropyl)spiro[chromene-2,4'-piperidine]-6-yl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(1'-propylspiro[chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;6-(3-methyl-4-oxo-1'-propan-2-ylspiro[1,3-benzoxazine-2,4'-piperidine]-6-yl)-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide.

What is the SMILES notation for 6-[1'-(3-methoxypropyl)spiro[chromene-2,4'-piperidine]-6-yl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(1'-propylspiro[chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;6-(3-methyl-4-oxo-1'-propan-2-ylspiro[1,3-benzoxazine-2,4'-piperidine]-6-yl)-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide?

The canonical SMILES for 6-[1'-(3-methoxypropyl)spiro[chromene-2,4'-piperidine]-6-yl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(1'-propylspiro[chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;6-(3-methyl-4-oxo-1'-propan-2-ylspiro[1,3-benzoxazine-2,4'-piperidine]-6-yl)-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide is CC(C)N1CCC2(CC1)Oc1ccc(-c3ccc(C(=O)NCc4cnn(C)c4)cn3)cc1C(=O)N2C.CCCN1CCC2(C=Cc3cc(-c4ccc(C(=O)NCc5cc(C)no5)cn4)ccc3O2)CC1.CCCN1CCC2(CC1)CC(=O)c1cc(-c3ccc(C(=O)NCc4cc(C)no4)cn3)ccc1O2.COCCCN1CCC2(C=Cc3cc(-c4ccc(C(=O)NCc5cccs5)cn4)ccc3O2)CC1.

What is the InChIKey of 6-[1'-(3-methoxypropyl)spiro[chromene-2,4'-piperidine]-6-yl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(1'-propylspiro[chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;6-(3-methyl-4-oxo-1'-propan-2-ylspiro[1,3-benzoxazine-2,4'-piperidine]-6-yl)-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide?

The InChIKey is RGBJSKZOXWRUHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H31N3O3S.C27H32N6O3.C27H30N4O4.C27H30N4O3/c1-33-16-3-13-31-14-11-28(12-15-31)10-9-22-18-21(6-8-26(22)34-28)25-7-5-23(19-29-25)27(32)30-20-24-4-2-17-35-24;1-18(2)33-11-9-27(10-12-33)32(4)26(35)22-13-20(6-8-24(22)36-27)23-7-5-21(16-28-23)25(34)29-14-19-15-30-31(3)17-19;1-3-10-31-11-8-27(9-12-31)15-24(32)22-14-19(5-7-25(22)34-27)23-6-4-20(16-28-23)26(33)29-17-21-13-18(2)30-35-21;1-3-12-31-13-10-27(11-14-31)9-8-21-16-20(5-7-25(21)33-27)24-6-4-22(17-28-24)26(32)29-18-23-15-19(2)30-34-23/h2,4-10,17-19H,3,11-16,20H2,1H3,(H,30,32);5-8,13,15-18H,9-12,14H2,1-4H3,(H,29,34);4-7,13-14,16H,3,8-12,15,17H2,1-2H3,(H,29,33);4-9,15-17H,3,10-14,18H2,1-2H3,(H,29,32).

What are the key properties of 6-[1'-(3-methoxypropyl)spiro[chromene-2,4'-piperidine]-6-yl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(1'-propylspiro[chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;6-(3-methyl-4-oxo-1'-propan-2-ylspiro[1,3-benzoxazine-2,4'-piperidine]-6-yl)-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide?

6-[1'-(3-methoxypropyl)spiro[chromene-2,4'-piperidine]-6-yl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(1'-propylspiro[chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;6-(3-methyl-4-oxo-1'-propan-2-ylspiro[1,3-benzoxazine-2,4'-piperidine]-6-yl)-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide has a molecular weight of 1911.36 g/mol, XLogP of 16.90, 25 rotatable bonds, 4 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[1'-(3-methoxypropyl)spiro[chromene-2,4'-piperidine]-6-yl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(1'-propylspiro[chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;6-(3-methyl-4-oxo-1'-propan-2-ylspiro[1,3-benzoxazine-2,4'-piperidine]-6-yl)-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 160615757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).