sodium;2-aminopyridine-3-carbaldehyde;ethanol;ethyl 4-bromo-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-hydroxypent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-oxopent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-(4-oxopentyl)-1H-pyrrole-2-carboxylate;4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylic acid;pent-4-en-2-ol;hydroxide

C90H114BrN12NaO19 — CID 158901821

IUPACsodium;2-aminopyridine-3-carbaldehyde;ethanol;ethyl 4-bromo-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-hydroxypent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-oxopent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-(4-oxopentyl)-1H-pyrrole-2-carboxylate;4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylic acid;pent-4-en-2-ol;hydroxide
SMILESC=CCC(C)O.CCO.CCOC(=O)c1cc(/C=C/CC(C)=O)c[nH]1.CCOC(=O)c1cc(/C=C/CC(C)O)c[nH]1.CCOC(=O)c1cc(Br)c[nH]1.CCOC(=O)c1cc(CCCC(C)=O)c[nH]1.CCOC(=O)c1cc(CCCc2ccc3cccnc3n2)c[nH]1.Nc1ncccc1C=O.O=C(O)c1cc(CCCc2ccc3cccnc3n2)c[nH]1.[Na+].[OH-]
InChIInChI=1S/C18H19N3O2.C16H15N3O2.2C12H17NO3.C12H15NO3.C7H8BrNO2.C6H6N2O.C5H10O.C2H6O.Na.H2O/c1-2-23-18(22)16-11-13(12-20-16)5-3-7-15-9-8-14-6-4-10-19-17(14)21-15;20-16(21)14-9-11(10-18-14)3-1-5-13-7-6-12-4-2-8-17-15(12)19-13;3*1-3-16-12(15)11-7-10(8-13-11)6-4-5-9(2)14;1-2-11-7(10)6-3-5(8)4-9-6;7-6-5(4-9)2-1-3-8-6;1-3-4-5(2)6;1-2-3;;/h4,6,8-12,20H,2-3,5,7H2,1H3;2,4,6-10,18H,1,3,5H2,(H,20,21);7-8,13H,3-6H2,1-2H3;4,6-9,13-14H,3,5H2,1-2H3;4,6-8,13H,3,5H2,1-2H3;3-4,9H,2H2,1H3;1-4H,(H2,7,8);3,5-6H,1,4H2,2H3;3H,2H2,1H3;;1H2/q;;;;;;;;;+1;/p-1/b;;;2*6-4+;;;;;;
InChIKeyJFNUNKMMFDXXMC-ZSECZEEKSA-M
MW1770.86 g/mol
LogP12.60
Rot. Bonds32

About sodium;2-aminopyridine-3-carbaldehyde;ethanol;ethyl 4-bromo-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-hydroxypent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-oxopent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-(4-oxopentyl)-1H-pyrrole-2-carboxylate;4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylic acid;pent-4-en-2-ol;hydroxide

sodium;2-aminopyridine-3-carbaldehyde;ethanol;ethyl 4-bromo-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-hydroxypent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-oxopent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-(4-oxopentyl)-1H-pyrrole-2-carboxylate;4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylic acid;pent-4-en-2-ol;hydroxide (PubChem CID 158901821) has the molecular formula C90H114BrN12NaO19 and a molecular weight of 1770.86 g/mol. Its IUPAC name is sodium;2-aminopyridine-3-carbaldehyde;ethanol;ethyl 4-bromo-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-hydroxypent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-oxopent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-(4-oxopentyl)-1H-pyrrole-2-carboxylate;4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylic acid;pent-4-en-2-ol;hydroxide.

Molecular Properties

Compound Namesodium;2-aminopyridine-3-carbaldehyde;ethanol;ethyl 4-bromo-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-hydroxypent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-oxopent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-(4-oxopentyl)-1H-pyrrole-2-carboxylate;4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylic acid;pent-4-en-2-ol;hydroxide
PubChem CID158901821
Molecular FormulaC90H114BrN12NaO19
Molecular Weight1770.86 g/mol
Exact Mass1768.74
IUPAC Namesodium;2-aminopyridine-3-carbaldehyde;ethanol;ethyl 4-bromo-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-hydroxypent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-oxopent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-(4-oxopentyl)-1H-pyrrole-2-carboxylate;4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylic acid;pent-4-en-2-ol;hydroxide
SMILESC=CCC(C)O.CCO.CCOC(=O)c1cc(/C=C/CC(C)=O)c[nH]1.CCOC(=O)c1cc(/C=C/CC(C)O)c[nH]1.CCOC(=O)c1cc(Br)c[nH]1.CCOC(=O)c1cc(CCCC(C)=O)c[nH]1.CCOC(=O)c1cc(CCCc2ccc3cccnc3n2)c[nH]1.Nc1ncccc1C=O.O=C(O)c1cc(CCCc2ccc3cccnc3n2)c[nH]1.[Na+].[OH-]
InChIInChI=1S/C18H19N3O2.C16H15N3O2.2C12H17NO3.C12H15NO3.C7H8BrNO2.C6H6N2O.C5H10O.C2H6O.Na.H2O/c1-2-23-18(22)16-11-13(12-20-16)5-3-7-15-9-8-14-6-4-10-19-17(14)21-15;20-16(21)14-9-11(10-18-14)3-1-5-13-7-6-12-4-2-8-17-15(12)19-13;3*1-3-16-12(15)11-7-10(8-13-11)6-4-5-9(2)14;1-2-11-7(10)6-3-5(8)4-9-6;7-6-5(4-9)2-1-3-8-6;1-3-4-5(2)6;1-2-3;;/h4,6,8-12,20H,2-3,5,7H2,1H3;2,4,6-10,18H,1,3,5H2,(H,20,21);7-8,13H,3-6H2,1-2H3;4,6-9,13-14H,3,5H2,1-2H3;4,6-8,13H,3,5H2,1-2H3;3-4,9H,2H2,1H3;1-4H,(H2,7,8);3,5-6H,1,4H2,2H3;3H,2H2,1H3;;1H2/q;;;;;;;;;+1;/p-1/b;;;2*6-4+;;;;;;
InChIKeyJFNUNKMMFDXXMC-ZSECZEEKSA-M
XLogP12.60
TPSA495.91 Ų
H-Bond Donors11
H-Bond Acceptors24
Rotatable Bonds32
Heavy Atoms123
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001770.86
LogP ≤ 512.60
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze sodium;2-aminopyridine-3-carbaldehyde;ethanol;ethyl 4-bromo-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-hydroxypent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-oxopent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-(4-oxopentyl)-1H-pyrrole-2-carboxylate;4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylic acid;pent-4-en-2-ol;hydroxide with MolForge

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Related Compounds

1-O-tert-butyl 2-O-ethyl 4-[(E)-2-(1,8-naphthyridin-2-yl)ethenyl]pyrrole-1,2-dicarboxylate;1-O-tert-butyl 2-O-ethyl 4-[(E)-2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethenyl]pyrrole-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;ethanol;ethyl (2S)-3-amino-2-(phenylmethoxycarbonylamino)propanoate;ethyl 4-[(E)-2-(1,8-naphthyridin-2-yl)ethenyl]-1H-pyrrole-2-carboxylate;(2S)-2-(phenylmethoxycarbonylamino)-3-[[4-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethyl]-1H-pyrrole-2-carbonyl]amino]propanoic acid;4-[(E)-2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethenyl]-1H-pyrrole-2-carboxylic acid
CID 157591482
1-O-tert-butyl 2-O-ethyl 4-[(E)-2-(1,8-naphthyridin-2-yl)ethenyl]pyrrole-1,2-dicarboxylate;1-O-tert-butyl 2-O-ethyl 4-[(E)-2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethenyl]pyrrole-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;ethanol;ethyl 4-[(E)-2-(1,8-naphthyridin-2-yl)ethenyl]-1H-pyrrole-2-carboxylate;methyl (2S)-3-amino-2-(phenylmethoxycarbonylamino)propanoate;(2S)-2-(phenylmethoxycarbonylamino)-3-[[4-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethyl]-1H-pyrrole-2-carbonyl]amino]propanoic acid;4-[(E)-2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethenyl]-1H-pyrrole-2-carboxylic acid
CID 157982711
sodium;2-aminopyridine-3-carbaldehyde;ethanol;ethyl 4-bromo-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-hydroxypent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-oxopent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-(4-oxopentyl)-1H-pyrrole-2-carboxylate;4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylic acid;pent-4-en-2-ol;hydroxide
CID 158044391
sodium;ethanol;ethyl 4-[(E)-2-(1,8-naphthyridin-2-yl)ethenyl]-1H-pyrrole-2-carboxylate;ethyl 4-[2-(5,6,7,8-tetrahydroquinolin-2-yl)ethyl]-1H-pyrrole-2-carboxylate;ethyl 4-[2-(5,6,7,8-tetrahydroquinolin-7-yl)ethyl]-1H-pyrrole-2-carboxylate;4-[2-(5,6,7,8-tetrahydroquinolin-7-yl)ethyl]-1H-pyrrole-2-carboxylic acid;hydroxide
CID 158773823
dicesium;2-aminopyridine-3-carbaldehyde;2-(2-bromoethyl)-2-methyl-1,3-dioxolane;hydride;methyl 1H-imidazole-5-carboxylate;methyl 1-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]imidazole-4-carboxylate;methyl 1-[2-(1,8-naphthyridin-2-yl)ethyl]imidazole-4-carboxylate;methyl 1-(3-oxobutyl)imidazole-4-carboxylate;methyl 1-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethyl]imidazole-4-carboxylate;oxido formate;1-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethyl]imidazole-4-carboxylic acid;hydrochloride
CID 159509839
sodium;2-aminopyridine-3-carbaldehyde;ethyl 4-formyl-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-2-(1,8-naphthyridin-2-yl)ethenyl]-1H-pyrrole-2-carboxylate;methane;2-methyl-1,8-naphthyridine;1-methyl-4-(sulfinatoamino)benzene;4-[(E)-2-(1,8-naphthyridin-2-yl)ethenyl]-1H-pyrrole-2-carboxylic acid;propan-2-one;hydroxide;hydrochloride
CID 159727958
sodium;2-aminopyridine-3-carbaldehyde;methyl 4-acetyl-1H-pyrrole-2-carboxylate;methyl 4-(1,8-naphthyridin-2-yl)-1H-pyrrole-2-carboxylate;4-(1,8-naphthyridin-2-yl)-1H-pyrrole-2-carboxylic acid;hydroxide;hydrochloride
CID 160894274
sodium;2-aminopyridine-3-carbaldehyde;ethyl 4-formyl-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-2-(1,8-naphthyridin-2-yl)ethenyl]-1H-pyrrole-2-carboxylate;2-methyl-1,8-naphthyridine;1-methyl-4-(sulfinatoamino)benzene;4-[(E)-2-(1,8-naphthyridin-2-yl)ethenyl]-1H-pyrrole-2-carboxylic acid;propan-2-one;hydroxide;hydrochloride
CID 160954508
2-amino-5-bromopyridine-3-carbaldehyde;2-aminopyridine-3-carbaldehyde;6-bromo-2-methyl-1,8-naphthyridine;N,7-dimethyl-1,8-naphthyridine-3-carboxamide;ethyl 7-methyl-1,8-naphthyridine-3-carboxylate;7-methyl-1,8-naphthyridine-3-carboxylic acid;propan-2-one
CID 161195248
dicesium;2-aminopyridine-3-carbaldehyde;2-(2-bromoethyl)-2-methyl-1,3-dioxolane;hydride;bis(methyl 1-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pyrazole-3-carboxylate);methyl 2-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pyrazole-3-carboxylate;methyl 1-[2-(1,8-naphthyridin-2-yl)ethyl]pyrazole-3-carboxylate;methyl 1-(3-oxobutyl)pyrazole-3-carboxylate;methyl 1H-pyrazole-5-carboxylate;methyl 1-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethyl]pyrazole-3-carboxylate;oxido formate;1-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethyl]pyrazole-3-carboxylic acid;hydrochloride
CID 161655222

Frequently Asked Questions

What is the IUPAC name of sodium;2-aminopyridine-3-carbaldehyde;ethanol;ethyl 4-bromo-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-hydroxypent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-oxopent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-(4-oxopentyl)-1H-pyrrole-2-carboxylate;4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylic acid;pent-4-en-2-ol;hydroxide?
The IUPAC name of sodium;2-aminopyridine-3-carbaldehyde;ethanol;ethyl 4-bromo-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-hydroxypent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-oxopent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-(4-oxopentyl)-1H-pyrrole-2-carboxylate;4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylic acid;pent-4-en-2-ol;hydroxide (CID 158901821) is sodium;2-aminopyridine-3-carbaldehyde;ethanol;ethyl 4-bromo-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-hydroxypent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-oxopent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-(4-oxopentyl)-1H-pyrrole-2-carboxylate;4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylic acid;pent-4-en-2-ol;hydroxide.
What is the SMILES notation for sodium;2-aminopyridine-3-carbaldehyde;ethanol;ethyl 4-bromo-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-hydroxypent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-oxopent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-(4-oxopentyl)-1H-pyrrole-2-carboxylate;4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylic acid;pent-4-en-2-ol;hydroxide?
The canonical SMILES for sodium;2-aminopyridine-3-carbaldehyde;ethanol;ethyl 4-bromo-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-hydroxypent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-oxopent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-(4-oxopentyl)-1H-pyrrole-2-carboxylate;4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylic acid;pent-4-en-2-ol;hydroxide is C=CCC(C)O.CCO.CCOC(=O)c1cc(/C=C/CC(C)=O)c[nH]1.CCOC(=O)c1cc(/C=C/CC(C)O)c[nH]1.CCOC(=O)c1cc(Br)c[nH]1.CCOC(=O)c1cc(CCCC(C)=O)c[nH]1.CCOC(=O)c1cc(CCCc2ccc3cccnc3n2)c[nH]1.Nc1ncccc1C=O.O=C(O)c1cc(CCCc2ccc3cccnc3n2)c[nH]1.[Na+].[OH-].
What is the InChIKey of sodium;2-aminopyridine-3-carbaldehyde;ethanol;ethyl 4-bromo-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-hydroxypent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-oxopent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-(4-oxopentyl)-1H-pyrrole-2-carboxylate;4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylic acid;pent-4-en-2-ol;hydroxide?
The InChIKey is JFNUNKMMFDXXMC-ZSECZEEKSA-M. The full InChI is InChI=1S/C18H19N3O2.C16H15N3O2.2C12H17NO3.C12H15NO3.C7H8BrNO2.C6H6N2O.C5H10O.C2H6O.Na.H2O/c1-2-23-18(22)16-11-13(12-20-16)5-3-7-15-9-8-14-6-4-10-19-17(14)21-15;20-16(21)14-9-11(10-18-14)3-1-5-13-7-6-12-4-2-8-17-15(12)19-13;3*1-3-16-12(15)11-7-10(8-13-11)6-4-5-9(2)14;1-2-11-7(10)6-3-5(8)4-9-6;7-6-5(4-9)2-1-3-8-6;1-3-4-5(2)6;1-2-3;;/h4,6,8-12,20H,2-3,5,7H2,1H3;2,4,6-10,18H,1,3,5H2,(H,20,21);7-8,13H,3-6H2,1-2H3;4,6-9,13-14H,3,5H2,1-2H3;4,6-8,13H,3,5H2,1-2H3;3-4,9H,2H2,1H3;1-4H,(H2,7,8);3,5-6H,1,4H2,2H3;3H,2H2,1H3;;1H2/q;;;;;;;;;+1;/p-1/b;;;2*6-4+;;;;;;.
What are the key properties of sodium;2-aminopyridine-3-carbaldehyde;ethanol;ethyl 4-bromo-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-hydroxypent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-oxopent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-(4-oxopentyl)-1H-pyrrole-2-carboxylate;4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylic acid;pent-4-en-2-ol;hydroxide?
sodium;2-aminopyridine-3-carbaldehyde;ethanol;ethyl 4-bromo-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-hydroxypent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-oxopent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-(4-oxopentyl)-1H-pyrrole-2-carboxylate;4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylic acid;pent-4-en-2-ol;hydroxide has a molecular weight of 1770.86 g/mol, XLogP of 12.60, 32 rotatable bonds, 11 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;2-aminopyridine-3-carbaldehyde;ethanol;ethyl 4-bromo-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-hydroxypent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylate;ethyl 4-[(E)-4-oxopent-1-enyl]-1H-pyrrole-2-carboxylate;ethyl 4-(4-oxopentyl)-1H-pyrrole-2-carboxylate;4-[3-(1,8-naphthyridin-2-yl)propyl]-1H-pyrrole-2-carboxylic acid;pent-4-en-2-ol;hydroxide is sourced from PubChem (CID 158901821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).