N-[3-[(6-acetyl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]-2-(4-chloro-3-fluorophenoxy)acetamide;2-(4-chloro-3-fluorophenoxy)-N-[3-[4-(methylideneamino)-3-(4-methylpiperazine-1-carboximidoyl)anilino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-morpholin-4-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-pyrrolidin-1-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;methyl 8-[[3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-1-bicyclo[1.1.1]pentanyl]amino]naphthalene-2-carboxylate

C117H125Cl5F3N19O14 — CID 162278580

IUPACN-[3-[(6-acetyl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]-2-(4-chloro-3-fluorophenoxy)acetamide;2-(4-chloro-3-fluorophenoxy)-N-[3-[4-(methylideneamino)-3-(4-methylpiperazine-1-carboximidoyl)anilino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-morpholin-4-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-pyrrolidin-1-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;methyl 8-[[3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-1-bicyclo[1.1.1]pentanyl]amino]naphthalene-2-carboxylate
SMILESCC(=O)c1cccc(NC23CC(NC(=O)COc4ccc(Cl)c(F)c4)(C2)C3)n1.COC(=O)c1ccc2cccc(NC34CC(NC(=O)COc5ccc(Cl)c(F)c5)(C3)C4)c2c1.Cc1cc(OCC(=O)NC23CC(Nc4cc(N5CCCC5)ccn4)(C2)C3)ccc1Cl.Cc1cc(OCC(=O)NC23CC(Nc4cc(N5CCOCC5)ccn4)(C2)C3)ccc1Cl.[H]/N=C(/c1cc(NC23CC(NC(=O)COc4ccc(Cl)c(F)c4)(C2)C3)ccc1N=C)N1CCN(C)CC1
InChIInChI=1S/C26H30ClFN6O2.C25H22ClFN2O4.C23H27ClN4O3.C23H27ClN4O2.C20H19ClFN3O3/c1-30-22-6-3-17(11-19(22)24(29)34-9-7-33(2)8-10-34)31-25-14-26(15-25,16-25)32-23(35)13-36-18-4-5-20(27)21(28)12-18;1-32-23(31)16-6-5-15-3-2-4-21(18(15)9-16)28-24-12-25(13-24,14-24)29-22(30)11-33-17-7-8-19(26)20(27)10-17;1-16-10-18(2-3-19(16)24)31-12-21(29)27-23-13-22(14-23,15-23)26-20-11-17(4-5-25-20)28-6-8-30-9-7-28;1-16-10-18(4-5-19(16)24)30-12-21(29)27-23-13-22(14-23,15-23)26-20-11-17(6-7-25-20)28-8-2-3-9-28;1-12(26)16-3-2-4-17(23-16)24-19-9-20(10-19,11-19)25-18(27)8-28-13-5-6-14(21)15(22)7-13/h3-6,11-12,29,31H,1,7-10,13-16H2,2H3,(H,32,35);2-10,28H,11-14H2,1H3,(H,29,30);2-5,10-11H,6-9,12-15H2,1H3,(H,25,26)(H,27,29);4-7,10-11H,2-3,8-9,12-15H2,1H3,(H,25,26)(H,27,29);2-7H,8-11H2,1H3,(H,23,24)(H,25,27)/b29-24-;;;;
InChIKeyTXSZYQWQVUCNHM-ZFCKKGRESA-N
MW2255.66 g/mol
LogP18.81
Rot. Bonds36

About N-[3-[(6-acetyl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]-2-(4-chloro-3-fluorophenoxy)acetamide;2-(4-chloro-3-fluorophenoxy)-N-[3-[4-(methylideneamino)-3-(4-methylpiperazine-1-carboximidoyl)anilino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-morpholin-4-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-pyrrolidin-1-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;methyl 8-[[3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-1-bicyclo[1.1.1]pentanyl]amino]naphthalene-2-carboxylate

N-[3-[(6-acetyl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]-2-(4-chloro-3-fluorophenoxy)acetamide;2-(4-chloro-3-fluorophenoxy)-N-[3-[4-(methylideneamino)-3-(4-methylpiperazine-1-carboximidoyl)anilino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-morpholin-4-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-pyrrolidin-1-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;methyl 8-[[3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-1-bicyclo[1.1.1]pentanyl]amino]naphthalene-2-carboxylate (PubChem CID 162278580) has the molecular formula C117H125Cl5F3N19O14 and a molecular weight of 2255.66 g/mol. Its IUPAC name is N-[3-[(6-acetyl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]-2-(4-chloro-3-fluorophenoxy)acetamide;2-(4-chloro-3-fluorophenoxy)-N-[3-[4-(methylideneamino)-3-(4-methylpiperazine-1-carboximidoyl)anilino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-morpholin-4-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-pyrrolidin-1-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;methyl 8-[[3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-1-bicyclo[1.1.1]pentanyl]amino]naphthalene-2-carboxylate.

Molecular Properties

Compound NameN-[3-[(6-acetyl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]-2-(4-chloro-3-fluorophenoxy)acetamide;2-(4-chloro-3-fluorophenoxy)-N-[3-[4-(methylideneamino)-3-(4-methylpiperazine-1-carboximidoyl)anilino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-morpholin-4-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-pyrrolidin-1-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;methyl 8-[[3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-1-bicyclo[1.1.1]pentanyl]amino]naphthalene-2-carboxylate
PubChem CID162278580
Molecular FormulaC117H125Cl5F3N19O14
Molecular Weight2255.66 g/mol
Exact Mass2251.80
IUPAC NameN-[3-[(6-acetyl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]-2-(4-chloro-3-fluorophenoxy)acetamide;2-(4-chloro-3-fluorophenoxy)-N-[3-[4-(methylideneamino)-3-(4-methylpiperazine-1-carboximidoyl)anilino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-morpholin-4-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-pyrrolidin-1-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;methyl 8-[[3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-1-bicyclo[1.1.1]pentanyl]amino]naphthalene-2-carboxylate
SMILESCC(=O)c1cccc(NC23CC(NC(=O)COc4ccc(Cl)c(F)c4)(C2)C3)n1.COC(=O)c1ccc2cccc(NC34CC(NC(=O)COc5ccc(Cl)c(F)c5)(C3)C4)c2c1.Cc1cc(OCC(=O)NC23CC(Nc4cc(N5CCCC5)ccn4)(C2)C3)ccc1Cl.Cc1cc(OCC(=O)NC23CC(Nc4cc(N5CCOCC5)ccn4)(C2)C3)ccc1Cl.[H]/N=C(/c1cc(NC23CC(NC(=O)COc4ccc(Cl)c(F)c4)(C2)C3)ccc1N=C)N1CCN(C)CC1
InChIInChI=1S/C26H30ClFN6O2.C25H22ClFN2O4.C23H27ClN4O3.C23H27ClN4O2.C20H19ClFN3O3/c1-30-22-6-3-17(11-19(22)24(29)34-9-7-33(2)8-10-34)31-25-14-26(15-25,16-25)32-23(35)13-36-18-4-5-20(27)21(28)12-18;1-32-23(31)16-6-5-15-3-2-4-21(18(15)9-16)28-24-12-25(13-24,14-24)29-22(30)11-33-17-7-8-19(26)20(27)10-17;1-16-10-18(2-3-19(16)24)31-12-21(29)27-23-13-22(14-23,15-23)26-20-11-17(4-5-25-20)28-6-8-30-9-7-28;1-16-10-18(4-5-19(16)24)30-12-21(29)27-23-13-22(14-23,15-23)26-20-11-17(6-7-25-20)28-8-2-3-9-28;1-12(26)16-3-2-4-17(23-16)24-19-9-20(10-19,11-19)25-18(27)8-28-13-5-6-14(21)15(22)7-13/h3-6,11-12,29,31H,1,7-10,13-16H2,2H3,(H,32,35);2-10,28H,11-14H2,1H3,(H,29,30);2-5,10-11H,6-9,12-15H2,1H3,(H,25,26)(H,27,29);4-7,10-11H,2-3,8-9,12-15H2,1H3,(H,25,26)(H,27,29);2-7H,8-11H2,1H3,(H,23,24)(H,25,27)/b29-24-;;;;
InChIKeyTXSZYQWQVUCNHM-ZFCKKGRESA-N
XLogP18.81
TPSA392.24 Ų
H-Bond Donors11
H-Bond Acceptors27
Rotatable Bonds36
Heavy Atoms158
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002255.66
LogP ≤ 518.81
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1027

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze N-[3-[(6-acetyl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]-2-(4-chloro-3-fluorophenoxy)acetamide;2-(4-chloro-3-fluorophenoxy)-N-[3-[4-(methylideneamino)-3-(4-methylpiperazine-1-carboximidoyl)anilino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-morpholin-4-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-pyrrolidin-1-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;methyl 8-[[3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-1-bicyclo[1.1.1]pentanyl]amino]naphthalene-2-carboxylate with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[3-[(6-acetyl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]-2-(4-chloro-3-fluorophenoxy)acetamide;2-(4-chloro-3-fluorophenoxy)-N-[3-[4-(methylideneamino)-3-(4-methylpiperazine-1-carboximidoyl)anilino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-morpholin-4-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-pyrrolidin-1-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;methyl 8-[[3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-1-bicyclo[1.1.1]pentanyl]amino]naphthalene-2-carboxylate?
The IUPAC name of N-[3-[(6-acetyl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]-2-(4-chloro-3-fluorophenoxy)acetamide;2-(4-chloro-3-fluorophenoxy)-N-[3-[4-(methylideneamino)-3-(4-methylpiperazine-1-carboximidoyl)anilino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-morpholin-4-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-pyrrolidin-1-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;methyl 8-[[3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-1-bicyclo[1.1.1]pentanyl]amino]naphthalene-2-carboxylate (CID 162278580) is N-[3-[(6-acetyl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]-2-(4-chloro-3-fluorophenoxy)acetamide;2-(4-chloro-3-fluorophenoxy)-N-[3-[4-(methylideneamino)-3-(4-methylpiperazine-1-carboximidoyl)anilino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-morpholin-4-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-pyrrolidin-1-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;methyl 8-[[3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-1-bicyclo[1.1.1]pentanyl]amino]naphthalene-2-carboxylate.
What is the SMILES notation for N-[3-[(6-acetyl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]-2-(4-chloro-3-fluorophenoxy)acetamide;2-(4-chloro-3-fluorophenoxy)-N-[3-[4-(methylideneamino)-3-(4-methylpiperazine-1-carboximidoyl)anilino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-morpholin-4-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-pyrrolidin-1-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;methyl 8-[[3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-1-bicyclo[1.1.1]pentanyl]amino]naphthalene-2-carboxylate?
The canonical SMILES for N-[3-[(6-acetyl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]-2-(4-chloro-3-fluorophenoxy)acetamide;2-(4-chloro-3-fluorophenoxy)-N-[3-[4-(methylideneamino)-3-(4-methylpiperazine-1-carboximidoyl)anilino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-morpholin-4-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-pyrrolidin-1-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;methyl 8-[[3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-1-bicyclo[1.1.1]pentanyl]amino]naphthalene-2-carboxylate is CC(=O)c1cccc(NC23CC(NC(=O)COc4ccc(Cl)c(F)c4)(C2)C3)n1.COC(=O)c1ccc2cccc(NC34CC(NC(=O)COc5ccc(Cl)c(F)c5)(C3)C4)c2c1.Cc1cc(OCC(=O)NC23CC(Nc4cc(N5CCCC5)ccn4)(C2)C3)ccc1Cl.Cc1cc(OCC(=O)NC23CC(Nc4cc(N5CCOCC5)ccn4)(C2)C3)ccc1Cl.[H]/N=C(/c1cc(NC23CC(NC(=O)COc4ccc(Cl)c(F)c4)(C2)C3)ccc1N=C)N1CCN(C)CC1.
What is the InChIKey of N-[3-[(6-acetyl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]-2-(4-chloro-3-fluorophenoxy)acetamide;2-(4-chloro-3-fluorophenoxy)-N-[3-[4-(methylideneamino)-3-(4-methylpiperazine-1-carboximidoyl)anilino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-morpholin-4-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-pyrrolidin-1-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;methyl 8-[[3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-1-bicyclo[1.1.1]pentanyl]amino]naphthalene-2-carboxylate?
The InChIKey is TXSZYQWQVUCNHM-ZFCKKGRESA-N. The full InChI is InChI=1S/C26H30ClFN6O2.C25H22ClFN2O4.C23H27ClN4O3.C23H27ClN4O2.C20H19ClFN3O3/c1-30-22-6-3-17(11-19(22)24(29)34-9-7-33(2)8-10-34)31-25-14-26(15-25,16-25)32-23(35)13-36-18-4-5-20(27)21(28)12-18;1-32-23(31)16-6-5-15-3-2-4-21(18(15)9-16)28-24-12-25(13-24,14-24)29-22(30)11-33-17-7-8-19(26)20(27)10-17;1-16-10-18(2-3-19(16)24)31-12-21(29)27-23-13-22(14-23,15-23)26-20-11-17(4-5-25-20)28-6-8-30-9-7-28;1-16-10-18(4-5-19(16)24)30-12-21(29)27-23-13-22(14-23,15-23)26-20-11-17(6-7-25-20)28-8-2-3-9-28;1-12(26)16-3-2-4-17(23-16)24-19-9-20(10-19,11-19)25-18(27)8-28-13-5-6-14(21)15(22)7-13/h3-6,11-12,29,31H,1,7-10,13-16H2,2H3,(H,32,35);2-10,28H,11-14H2,1H3,(H,29,30);2-5,10-11H,6-9,12-15H2,1H3,(H,25,26)(H,27,29);4-7,10-11H,2-3,8-9,12-15H2,1H3,(H,25,26)(H,27,29);2-7H,8-11H2,1H3,(H,23,24)(H,25,27)/b29-24-;;;;.
What are the key properties of N-[3-[(6-acetyl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]-2-(4-chloro-3-fluorophenoxy)acetamide;2-(4-chloro-3-fluorophenoxy)-N-[3-[4-(methylideneamino)-3-(4-methylpiperazine-1-carboximidoyl)anilino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-morpholin-4-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-pyrrolidin-1-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;methyl 8-[[3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-1-bicyclo[1.1.1]pentanyl]amino]naphthalene-2-carboxylate?
N-[3-[(6-acetyl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]-2-(4-chloro-3-fluorophenoxy)acetamide;2-(4-chloro-3-fluorophenoxy)-N-[3-[4-(methylideneamino)-3-(4-methylpiperazine-1-carboximidoyl)anilino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-morpholin-4-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-pyrrolidin-1-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;methyl 8-[[3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-1-bicyclo[1.1.1]pentanyl]amino]naphthalene-2-carboxylate has a molecular weight of 2255.66 g/mol, XLogP of 18.81, 36 rotatable bonds, 11 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(6-acetyl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]-2-(4-chloro-3-fluorophenoxy)acetamide;2-(4-chloro-3-fluorophenoxy)-N-[3-[4-(methylideneamino)-3-(4-methylpiperazine-1-carboximidoyl)anilino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-morpholin-4-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;2-(4-chloro-3-methylphenoxy)-N-[3-[(4-pyrrolidin-1-yl-2-pyridinyl)amino]-1-bicyclo[1.1.1]pentanyl]acetamide;methyl 8-[[3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-1-bicyclo[1.1.1]pentanyl]amino]naphthalene-2-carboxylate is sourced from PubChem (CID 162278580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).