2-acetamido-2-[1-hydroxy-4-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butanoylamino]cyclohexyl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydroquinolin-2-yl)pentanoyl]piperidin-4-yl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[4-(5,6,7,8-tetrahydroquinolin-2-yl)piperidine-1-carbonyl]piperidin-4-yl]acetic acid;2-(cyclopentanecarbonylamino)-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentyl]piperidin-4-yl]acetic acid;4-hydroxy-4-(1-hydroxy-2-oxopropyl)-N-[3-(5,6,7,8-tetrahydroquinolin-2-yl)propyl]piperidine-1-carboxamide;2-[4-hydroxy-1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propylcarbamoyl]piperidin-4-yl]-2-(4-oxooctanoylamino)acetic acid

C143H211N23O29 — CID 157454890

About 2-acetamido-2-[1-hydroxy-4-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butanoylamino]cyclohexyl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydroquinolin-2-yl)pentanoyl]piperidin-4-yl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[4-(5,6,7,8-tetrahydroquinolin-2-yl)piperidine-1-carbonyl]piperidin-4-yl]acetic acid;2-(cyclopentanecarbonylamino)-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentyl]piperidin-4-yl]acetic acid;4-hydroxy-4-(1-hydroxy-2-oxopropyl)-N-[3-(5,6,7,8-tetrahydroquinolin-2-yl)propyl]piperidine-1-carboxamide;2-[4-hydroxy-1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propylcarbamoyl]piperidin-4-yl]-2-(4-oxooctanoylamino)acetic acid

2-acetamido-2-[1-hydroxy-4-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butanoylamino]cyclohexyl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydroquinolin-2-yl)pentanoyl]piperidin-4-yl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[4-(5,6,7,8-tetrahydroquinolin-2-yl)piperidine-1-carbonyl]piperidin-4-yl]acetic acid;2-(cyclopentanecarbonylamino)-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentyl]piperidin-4-yl]acetic acid;4-hydroxy-4-(1-hydroxy-2-oxopropyl)-N-[3-(5,6,7,8-tetrahydroquinolin-2-yl)propyl]piperidine-1-carboxamide;2-[4-hydroxy-1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propylcarbamoyl]piperidin-4-yl]-2-(4-oxooctanoylamino)acetic acid (PubChem CID 157454890) has the molecular formula C143H211N23O29 and a molecular weight of 2716.39 g/mol. Its IUPAC name is 2-acetamido-2-[1-hydroxy-4-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butanoylamino]cyclohexyl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydroquinolin-2-yl)pentanoyl]piperidin-4-yl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[4-(5,6,7,8-tetrahydroquinolin-2-yl)piperidine-1-carbonyl]piperidin-4-yl]acetic acid;2-(cyclopentanecarbonylamino)-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentyl]piperidin-4-yl]acetic acid;4-hydroxy-4-(1-hydroxy-2-oxopropyl)-N-[3-(5,6,7,8-tetrahydroquinolin-2-yl)propyl]piperidine-1-carboxamide;2-[4-hydroxy-1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propylcarbamoyl]piperidin-4-yl]-2-(4-oxooctanoylamino)acetic acid.

Molecular Properties

• Compound Name: 2-acetamido-2-[1-hydroxy-4-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butanoylamino]cyclohexyl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydroquinolin-2-yl)pentanoyl]piperidin-4-yl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[4-(5,6,7,8-tetrahydroquinolin-2-yl)piperidine-1-carbonyl]piperidin-4-yl]acetic acid;2-(cyclopentanecarbonylamino)-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentyl]piperidin-4-yl]acetic acid;4-hydroxy-4-(1-hydroxy-2-oxopropyl)-N-[3-(5,6,7,8-tetrahydroquinolin-2-yl)propyl]piperidine-1-carboxamide;2-[4-hydroxy-1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propylcarbamoyl]piperidin-4-yl]-2-(4-oxooctanoylamino)acetic acid
• PubChem CID: 157454890
• Molecular Formula: C143H211N23O29
• Molecular Weight: 2716.39 g/mol
• Exact Mass: 2714.57
• IUPAC Name: 2-acetamido-2-[1-hydroxy-4-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butanoylamino]cyclohexyl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydroquinolin-2-yl)pentanoyl]piperidin-4-yl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[4-(5,6,7,8-tetrahydroquinolin-2-yl)piperidine-1-carbonyl]piperidin-4-yl]acetic acid;2-(cyclopentanecarbonylamino)-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentyl]piperidin-4-yl]acetic acid;4-hydroxy-4-(1-hydroxy-2-oxopropyl)-N-[3-(5,6,7,8-tetrahydroquinolin-2-yl)propyl]piperidine-1-carboxamide;2-[4-hydroxy-1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propylcarbamoyl]piperidin-4-yl]-2-(4-oxooctanoylamino)acetic acid
• SMILES: CC(=O)C(O)C1(O)CCN(C(=O)NCCCc2ccc3c(n2)CCCC3)CC1.CC(=O)NC(C(=O)O)C1(O)CCC(NC(=O)CCCc2ccc3c(n2)NCCC3)CC1.CC(=O)N[C@@H](C(=O)O)C1(O)CCN(C(=O)CCCCc2ccc3c(n2)CCCC3)CC1.CC(=O)N[C@@H](C(=O)O)C1(O)CCN(C(=O)N2CCC(c3ccc4c(n3)CCCC4)CC2)CC1.CCCCC(=O)CCC(=O)NC(C(=O)O)C1(O)CCN(C(=O)NCCCc2ccc3c(n2)NCCC3)CC1.O=C(NC(C(=O)O)C1(O)CCN(CCCCCc2ccc3c(n2)NCCC3)CC1)C1CCCC1
• InChI: InChI=1S/C27H41N5O6.C26H40N4O4.C24H34N4O5.C23H33N3O5.C22H32N4O5.C21H31N3O4/c1-2-3-8-21(33)11-12-22(34)31-23(25(35)36)27(38)13-17-32(18-14-27)26(37)29-16-5-7-20-10-9-19-6-4-15-28-24(19)30-20;31-24(20-7-3-4-8-20)29-22(25(32)33)26(34)13-17-30(18-14-26)16-5-1-2-10-21-12-11-19-9-6-15-27-23(19)28-21;1-16(29)25-21(22(30)31)24(33)10-14-28(15-11-24)23(32)27-12-8-18(9-13-27)20-7-6-17-4-2-3-5-19(17)26-20;1-16(27)24-21(22(29)30)23(31)12-14-26(15-13-23)20(28)9-5-3-7-18-11-10-17-6-2-4-8-19(17)25-18;1-14(27)24-19(21(29)30)22(31)11-9-17(10-12-22)25-18(28)6-2-5-16-8-7-15-4-3-13-23-20(15)26-16;1-15(25)19(26)21(28)10-13-24(14-11-21)20(27)22-12-4-6-17-9-8-16-5-2-3-7-18(16)23-17/h9-10,23,38H,2-8,11-18H2,1H3,(H,28,30)(H,29,37)(H,31,34)(H,35,36);11-12,20,22,34H,1-10,13-18H2,(H,27,28)(H,29,31)(H,32,33);6-7,18,21,33H,2-5,8-15H2,1H3,(H,25,29)(H,30,31);10-11,21,31H,2-9,12-15H2,1H3,(H,24,27)(H,29,30);7-8,17,19,31H,2-6,9-13H2,1H3,(H,23,26)(H,24,27)(H,25,28)(H,29,30);8-9,19,26,28H,2-7,10-14H2,1H3,(H,22,27)/t;;2*21-;;/m..00../s1
• InChIKey: BTFWSUSHODDJGX-VMIPILDDSA-N
• XLogP: 10.57
• TPSA: 762.06 Ų
• H-Bond Donors: 23
• H-Bond Acceptors: 34
• Rotatable Bonds: 49
• Heavy Atoms: 195
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2716.39
LogP ≤ 5	10.57
H-Bond Donors ≤ 5	23
H-Bond Acceptors ≤ 10	34

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-2-[1-hydroxy-4-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butanoylamino]cyclohexyl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydroquinolin-2-yl)pentanoyl]piperidin-4-yl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[4-(5,6,7,8-tetrahydroquinolin-2-yl)piperidine-1-carbonyl]piperidin-4-yl]acetic acid;2-(cyclopentanecarbonylamino)-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentyl]piperidin-4-yl]acetic acid;4-hydroxy-4-(1-hydroxy-2-oxopropyl)-N-[3-(5,6,7,8-tetrahydroquinolin-2-yl)propyl]piperidine-1-carboxamide;2-[4-hydroxy-1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propylcarbamoyl]piperidin-4-yl]-2-(4-oxooctanoylamino)acetic acid?

The IUPAC name of 2-acetamido-2-[1-hydroxy-4-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butanoylamino]cyclohexyl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydroquinolin-2-yl)pentanoyl]piperidin-4-yl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[4-(5,6,7,8-tetrahydroquinolin-2-yl)piperidine-1-carbonyl]piperidin-4-yl]acetic acid;2-(cyclopentanecarbonylamino)-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentyl]piperidin-4-yl]acetic acid;4-hydroxy-4-(1-hydroxy-2-oxopropyl)-N-[3-(5,6,7,8-tetrahydroquinolin-2-yl)propyl]piperidine-1-carboxamide;2-[4-hydroxy-1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propylcarbamoyl]piperidin-4-yl]-2-(4-oxooctanoylamino)acetic acid (CID 157454890) is 2-acetamido-2-[1-hydroxy-4-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butanoylamino]cyclohexyl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydroquinolin-2-yl)pentanoyl]piperidin-4-yl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[4-(5,6,7,8-tetrahydroquinolin-2-yl)piperidine-1-carbonyl]piperidin-4-yl]acetic acid;2-(cyclopentanecarbonylamino)-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentyl]piperidin-4-yl]acetic acid;4-hydroxy-4-(1-hydroxy-2-oxopropyl)-N-[3-(5,6,7,8-tetrahydroquinolin-2-yl)propyl]piperidine-1-carboxamide;2-[4-hydroxy-1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propylcarbamoyl]piperidin-4-yl]-2-(4-oxooctanoylamino)acetic acid.

What is the SMILES notation for 2-acetamido-2-[1-hydroxy-4-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butanoylamino]cyclohexyl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydroquinolin-2-yl)pentanoyl]piperidin-4-yl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[4-(5,6,7,8-tetrahydroquinolin-2-yl)piperidine-1-carbonyl]piperidin-4-yl]acetic acid;2-(cyclopentanecarbonylamino)-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentyl]piperidin-4-yl]acetic acid;4-hydroxy-4-(1-hydroxy-2-oxopropyl)-N-[3-(5,6,7,8-tetrahydroquinolin-2-yl)propyl]piperidine-1-carboxamide;2-[4-hydroxy-1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propylcarbamoyl]piperidin-4-yl]-2-(4-oxooctanoylamino)acetic acid?

The canonical SMILES for 2-acetamido-2-[1-hydroxy-4-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butanoylamino]cyclohexyl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydroquinolin-2-yl)pentanoyl]piperidin-4-yl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[4-(5,6,7,8-tetrahydroquinolin-2-yl)piperidine-1-carbonyl]piperidin-4-yl]acetic acid;2-(cyclopentanecarbonylamino)-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentyl]piperidin-4-yl]acetic acid;4-hydroxy-4-(1-hydroxy-2-oxopropyl)-N-[3-(5,6,7,8-tetrahydroquinolin-2-yl)propyl]piperidine-1-carboxamide;2-[4-hydroxy-1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propylcarbamoyl]piperidin-4-yl]-2-(4-oxooctanoylamino)acetic acid is CC(=O)C(O)C1(O)CCN(C(=O)NCCCc2ccc3c(n2)CCCC3)CC1.CC(=O)NC(C(=O)O)C1(O)CCC(NC(=O)CCCc2ccc3c(n2)NCCC3)CC1.CC(=O)N[C@@H](C(=O)O)C1(O)CCN(C(=O)CCCCc2ccc3c(n2)CCCC3)CC1.CC(=O)N[C@@H](C(=O)O)C1(O)CCN(C(=O)N2CCC(c3ccc4c(n3)CCCC4)CC2)CC1.CCCCC(=O)CCC(=O)NC(C(=O)O)C1(O)CCN(C(=O)NCCCc2ccc3c(n2)NCCC3)CC1.O=C(NC(C(=O)O)C1(O)CCN(CCCCCc2ccc3c(n2)NCCC3)CC1)C1CCCC1.

What is the InChIKey of 2-acetamido-2-[1-hydroxy-4-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butanoylamino]cyclohexyl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydroquinolin-2-yl)pentanoyl]piperidin-4-yl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[4-(5,6,7,8-tetrahydroquinolin-2-yl)piperidine-1-carbonyl]piperidin-4-yl]acetic acid;2-(cyclopentanecarbonylamino)-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentyl]piperidin-4-yl]acetic acid;4-hydroxy-4-(1-hydroxy-2-oxopropyl)-N-[3-(5,6,7,8-tetrahydroquinolin-2-yl)propyl]piperidine-1-carboxamide;2-[4-hydroxy-1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propylcarbamoyl]piperidin-4-yl]-2-(4-oxooctanoylamino)acetic acid?

The InChIKey is BTFWSUSHODDJGX-VMIPILDDSA-N. The full InChI is InChI=1S/C27H41N5O6.C26H40N4O4.C24H34N4O5.C23H33N3O5.C22H32N4O5.C21H31N3O4/c1-2-3-8-21(33)11-12-22(34)31-23(25(35)36)27(38)13-17-32(18-14-27)26(37)29-16-5-7-20-10-9-19-6-4-15-28-24(19)30-20;31-24(20-7-3-4-8-20)29-22(25(32)33)26(34)13-17-30(18-14-26)16-5-1-2-10-21-12-11-19-9-6-15-27-23(19)28-21;1-16(29)25-21(22(30)31)24(33)10-14-28(15-11-24)23(32)27-12-8-18(9-13-27)20-7-6-17-4-2-3-5-19(17)26-20;1-16(27)24-21(22(29)30)23(31)12-14-26(15-13-23)20(28)9-5-3-7-18-11-10-17-6-2-4-8-19(17)25-18;1-14(27)24-19(21(29)30)22(31)11-9-17(10-12-22)25-18(28)6-2-5-16-8-7-15-4-3-13-23-20(15)26-16;1-15(25)19(26)21(28)10-13-24(14-11-21)20(27)22-12-4-6-17-9-8-16-5-2-3-7-18(16)23-17/h9-10,23,38H,2-8,11-18H2,1H3,(H,28,30)(H,29,37)(H,31,34)(H,35,36);11-12,20,22,34H,1-10,13-18H2,(H,27,28)(H,29,31)(H,32,33);6-7,18,21,33H,2-5,8-15H2,1H3,(H,25,29)(H,30,31);10-11,21,31H,2-9,12-15H2,1H3,(H,24,27)(H,29,30);7-8,17,19,31H,2-6,9-13H2,1H3,(H,23,26)(H,24,27)(H,25,28)(H,29,30);8-9,19,26,28H,2-7,10-14H2,1H3,(H,22,27)/t;;2*21-;;/m..00../s1.

What are the key properties of 2-acetamido-2-[1-hydroxy-4-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butanoylamino]cyclohexyl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydroquinolin-2-yl)pentanoyl]piperidin-4-yl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[4-(5,6,7,8-tetrahydroquinolin-2-yl)piperidine-1-carbonyl]piperidin-4-yl]acetic acid;2-(cyclopentanecarbonylamino)-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentyl]piperidin-4-yl]acetic acid;4-hydroxy-4-(1-hydroxy-2-oxopropyl)-N-[3-(5,6,7,8-tetrahydroquinolin-2-yl)propyl]piperidine-1-carboxamide;2-[4-hydroxy-1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propylcarbamoyl]piperidin-4-yl]-2-(4-oxooctanoylamino)acetic acid?

2-acetamido-2-[1-hydroxy-4-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butanoylamino]cyclohexyl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydroquinolin-2-yl)pentanoyl]piperidin-4-yl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[4-(5,6,7,8-tetrahydroquinolin-2-yl)piperidine-1-carbonyl]piperidin-4-yl]acetic acid;2-(cyclopentanecarbonylamino)-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentyl]piperidin-4-yl]acetic acid;4-hydroxy-4-(1-hydroxy-2-oxopropyl)-N-[3-(5,6,7,8-tetrahydroquinolin-2-yl)propyl]piperidine-1-carboxamide;2-[4-hydroxy-1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propylcarbamoyl]piperidin-4-yl]-2-(4-oxooctanoylamino)acetic acid has a molecular weight of 2716.39 g/mol, XLogP of 10.57, 49 rotatable bonds, 23 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for 2-acetamido-2-[1-hydroxy-4-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butanoylamino]cyclohexyl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydroquinolin-2-yl)pentanoyl]piperidin-4-yl]acetic acid;(2R)-2-acetamido-2-[4-hydroxy-1-[4-(5,6,7,8-tetrahydroquinolin-2-yl)piperidine-1-carbonyl]piperidin-4-yl]acetic acid;2-(cyclopentanecarbonylamino)-2-[4-hydroxy-1-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentyl]piperidin-4-yl]acetic acid;4-hydroxy-4-(1-hydroxy-2-oxopropyl)-N-[3-(5,6,7,8-tetrahydroquinolin-2-yl)propyl]piperidine-1-carboxamide;2-[4-hydroxy-1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propylcarbamoyl]piperidin-4-yl]-2-(4-oxooctanoylamino)acetic acid is sourced from PubChem (CID 157454890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).