1-[5-(2-cyclobutyloxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[(2-cyclopropyl-1,3-oxazol-4-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]urea;1-[5-(2-cyclopropyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[5-[2-(methoxymethyl)-4-pyridinyl]-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;N-[4-[4-[(1-propan-2-ylpyrazol-3-yl)sulfonylcarbamoylamino]-2,3-dihydro-1H-inden-5-yl]-2-pyridinyl]acetamide

C117H131N25O20S5 — CID 159211911

About 1-[5-(2-cyclobutyloxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[(2-cyclopropyl-1,3-oxazol-4-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]urea;1-[5-(2-cyclopropyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[5-[2-(methoxymethyl)-4-pyridinyl]-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;N-[4-[4-[(1-propan-2-ylpyrazol-3-yl)sulfonylcarbamoylamino]-2,3-dihydro-1H-inden-5-yl]-2-pyridinyl]acetamide

1-[5-(2-cyclobutyloxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[(2-cyclopropyl-1,3-oxazol-4-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]urea;1-[5-(2-cyclopropyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[5-[2-(methoxymethyl)-4-pyridinyl]-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;N-[4-[4-[(1-propan-2-ylpyrazol-3-yl)sulfonylcarbamoylamino]-2,3-dihydro-1H-inden-5-yl]-2-pyridinyl]acetamide (PubChem CID 159211911) has the molecular formula C117H131N25O20S5 and a molecular weight of 2367.82 g/mol. Its IUPAC name is 1-[5-(2-cyclobutyloxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[(2-cyclopropyl-1,3-oxazol-4-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]urea;1-[5-(2-cyclopropyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[5-[2-(methoxymethyl)-4-pyridinyl]-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;N-[4-[4-[(1-propan-2-ylpyrazol-3-yl)sulfonylcarbamoylamino]-2,3-dihydro-1H-inden-5-yl]-2-pyridinyl]acetamide.

Molecular Properties

• Compound Name: 1-[5-(2-cyclobutyloxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[(2-cyclopropyl-1,3-oxazol-4-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]urea;1-[5-(2-cyclopropyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[5-[2-(methoxymethyl)-4-pyridinyl]-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;N-[4-[4-[(1-propan-2-ylpyrazol-3-yl)sulfonylcarbamoylamino]-2,3-dihydro-1H-inden-5-yl]-2-pyridinyl]acetamide
• PubChem CID: 159211911
• Molecular Formula: C117H131N25O20S5
• Molecular Weight: 2367.82 g/mol
• Exact Mass: 2365.86
• IUPAC Name: 1-[5-(2-cyclobutyloxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[(2-cyclopropyl-1,3-oxazol-4-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]urea;1-[5-(2-cyclopropyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[5-[2-(methoxymethyl)-4-pyridinyl]-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;N-[4-[4-[(1-propan-2-ylpyrazol-3-yl)sulfonylcarbamoylamino]-2,3-dihydro-1H-inden-5-yl]-2-pyridinyl]acetamide
• SMILES: CC(=O)Nc1cc(-c2ccc3c(c2NC(=O)NS(=O)(=O)c2ccn(C(C)C)n2)CCC3)ccn1.CC(C)n1ccc(S(=O)(=O)NC(=O)Nc2c(-c3ccnc(C4CC4)c3)ccc3c2CCC3)n1.CC(C)n1ccc(S(=O)(=O)NC(=O)Nc2c(-c3ccnc(OC4CCC4)c3)ccc3c2CCC3)n1.COCc1cc(-c2ccc3c(c2NC(=O)NS(=O)(=O)c2ccn(C(C)C)n2)CCC3)ccn1.COc1cc(-c2ccc3c(c2NC(=O)NS(=O)(=O)c2coc(C4CC4)n2)CCC3)ccn1
• InChI: InChI=1S/C25H29N5O4S.C24H27N5O3S.C23H26N6O4S.C23H27N5O4S.C22H22N4O5S/c1-16(2)30-14-12-23(28-30)35(32,33)29-25(31)27-24-20-8-3-5-17(20)9-10-21(24)18-11-13-26-22(15-18)34-19-6-4-7-19;1-15(2)29-13-11-22(27-29)33(31,32)28-24(30)26-23-19-5-3-4-16(19)8-9-20(23)18-10-12-25-21(14-18)17-6-7-17;1-14(2)29-12-10-21(27-29)34(32,33)28-23(31)26-22-18-6-4-5-16(18)7-8-19(22)17-9-11-24-20(13-17)25-15(3)30;1-15(2)28-12-10-21(26-28)33(30,31)27-23(29)25-22-19-6-4-5-16(19)7-8-20(22)17-9-11-24-18(13-17)14-32-3;1-30-18-11-15(9-10-23-18)17-8-7-13-3-2-4-16(13)20(17)25-22(27)26-32(28,29)19-12-31-21(24-19)14-5-6-14/h9-16,19H,3-8H2,1-2H3,(H2,27,29,31);8-15,17H,3-7H2,1-2H3,(H2,26,28,30);7-14H,4-6H2,1-3H3,(H,24,25,30)(H2,26,28,31);7-13,15H,4-6,14H2,1-3H3,(H2,25,27,29);7-12,14H,2-6H2,1H3,(H2,25,26,27)
• InChIKey: KQPBLIICIYPYOH-UHFFFAOYSA-N
• XLogP: 19.64
• TPSA: 594.90 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 34
• Rotatable Bonds: 32
• Heavy Atoms: 167
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2367.82
LogP ≤ 5	19.64
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	34

Frequently Asked Questions

What is the IUPAC name of 1-[5-(2-cyclobutyloxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[(2-cyclopropyl-1,3-oxazol-4-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]urea;1-[5-(2-cyclopropyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[5-[2-(methoxymethyl)-4-pyridinyl]-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;N-[4-[4-[(1-propan-2-ylpyrazol-3-yl)sulfonylcarbamoylamino]-2,3-dihydro-1H-inden-5-yl]-2-pyridinyl]acetamide?

The IUPAC name of 1-[5-(2-cyclobutyloxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[(2-cyclopropyl-1,3-oxazol-4-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]urea;1-[5-(2-cyclopropyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[5-[2-(methoxymethyl)-4-pyridinyl]-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;N-[4-[4-[(1-propan-2-ylpyrazol-3-yl)sulfonylcarbamoylamino]-2,3-dihydro-1H-inden-5-yl]-2-pyridinyl]acetamide (CID 159211911) is 1-[5-(2-cyclobutyloxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[(2-cyclopropyl-1,3-oxazol-4-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]urea;1-[5-(2-cyclopropyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[5-[2-(methoxymethyl)-4-pyridinyl]-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;N-[4-[4-[(1-propan-2-ylpyrazol-3-yl)sulfonylcarbamoylamino]-2,3-dihydro-1H-inden-5-yl]-2-pyridinyl]acetamide.

What is the SMILES notation for 1-[5-(2-cyclobutyloxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[(2-cyclopropyl-1,3-oxazol-4-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]urea;1-[5-(2-cyclopropyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[5-[2-(methoxymethyl)-4-pyridinyl]-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;N-[4-[4-[(1-propan-2-ylpyrazol-3-yl)sulfonylcarbamoylamino]-2,3-dihydro-1H-inden-5-yl]-2-pyridinyl]acetamide?

The canonical SMILES for 1-[5-(2-cyclobutyloxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[(2-cyclopropyl-1,3-oxazol-4-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]urea;1-[5-(2-cyclopropyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[5-[2-(methoxymethyl)-4-pyridinyl]-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;N-[4-[4-[(1-propan-2-ylpyrazol-3-yl)sulfonylcarbamoylamino]-2,3-dihydro-1H-inden-5-yl]-2-pyridinyl]acetamide is CC(=O)Nc1cc(-c2ccc3c(c2NC(=O)NS(=O)(=O)c2ccn(C(C)C)n2)CCC3)ccn1.CC(C)n1ccc(S(=O)(=O)NC(=O)Nc2c(-c3ccnc(C4CC4)c3)ccc3c2CCC3)n1.CC(C)n1ccc(S(=O)(=O)NC(=O)Nc2c(-c3ccnc(OC4CCC4)c3)ccc3c2CCC3)n1.COCc1cc(-c2ccc3c(c2NC(=O)NS(=O)(=O)c2ccn(C(C)C)n2)CCC3)ccn1.COc1cc(-c2ccc3c(c2NC(=O)NS(=O)(=O)c2coc(C4CC4)n2)CCC3)ccn1.

What is the InChIKey of 1-[5-(2-cyclobutyloxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[(2-cyclopropyl-1,3-oxazol-4-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]urea;1-[5-(2-cyclopropyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[5-[2-(methoxymethyl)-4-pyridinyl]-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;N-[4-[4-[(1-propan-2-ylpyrazol-3-yl)sulfonylcarbamoylamino]-2,3-dihydro-1H-inden-5-yl]-2-pyridinyl]acetamide?

The InChIKey is KQPBLIICIYPYOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H29N5O4S.C24H27N5O3S.C23H26N6O4S.C23H27N5O4S.C22H22N4O5S/c1-16(2)30-14-12-23(28-30)35(32,33)29-25(31)27-24-20-8-3-5-17(20)9-10-21(24)18-11-13-26-22(15-18)34-19-6-4-7-19;1-15(2)29-13-11-22(27-29)33(31,32)28-24(30)26-23-19-5-3-4-16(19)8-9-20(23)18-10-12-25-21(14-18)17-6-7-17;1-14(2)29-12-10-21(27-29)34(32,33)28-23(31)26-22-18-6-4-5-16(18)7-8-19(22)17-9-11-24-20(13-17)25-15(3)30;1-15(2)28-12-10-21(26-28)33(30,31)27-23(29)25-22-19-6-4-5-16(19)7-8-20(22)17-9-11-24-18(13-17)14-32-3;1-30-18-11-15(9-10-23-18)17-8-7-13-3-2-4-16(13)20(17)25-22(27)26-32(28,29)19-12-31-21(24-19)14-5-6-14/h9-16,19H,3-8H2,1-2H3,(H2,27,29,31);8-15,17H,3-7H2,1-2H3,(H2,26,28,30);7-14H,4-6H2,1-3H3,(H,24,25,30)(H2,26,28,31);7-13,15H,4-6,14H2,1-3H3,(H2,25,27,29);7-12,14H,2-6H2,1H3,(H2,25,26,27).

What are the key properties of 1-[5-(2-cyclobutyloxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[(2-cyclopropyl-1,3-oxazol-4-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]urea;1-[5-(2-cyclopropyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[5-[2-(methoxymethyl)-4-pyridinyl]-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;N-[4-[4-[(1-propan-2-ylpyrazol-3-yl)sulfonylcarbamoylamino]-2,3-dihydro-1H-inden-5-yl]-2-pyridinyl]acetamide?

1-[5-(2-cyclobutyloxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[(2-cyclopropyl-1,3-oxazol-4-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]urea;1-[5-(2-cyclopropyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[5-[2-(methoxymethyl)-4-pyridinyl]-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;N-[4-[4-[(1-propan-2-ylpyrazol-3-yl)sulfonylcarbamoylamino]-2,3-dihydro-1H-inden-5-yl]-2-pyridinyl]acetamide has a molecular weight of 2367.82 g/mol, XLogP of 19.64, 32 rotatable bonds, 11 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[5-(2-cyclobutyloxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[(2-cyclopropyl-1,3-oxazol-4-yl)sulfonyl]-3-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]urea;1-[5-(2-cyclopropyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[5-[2-(methoxymethyl)-4-pyridinyl]-2,3-dihydro-1H-inden-4-yl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;N-[4-[4-[(1-propan-2-ylpyrazol-3-yl)sulfonylcarbamoylamino]-2,3-dihydro-1H-inden-5-yl]-2-pyridinyl]acetamide is sourced from PubChem (CID 159211911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).