5-aminopyridine-2-carbonitrile;tert-butyl N-[[5-[4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-2-oxobutyl]-2-pyridinyl]methyl]-N-(2-methoxyethyl)carbamate;tert-butyl N-(2-methoxyethyl)-N-[[5-(2-oxopropyl)-2-pyridinyl]methyl]carbamate;4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-1-[6-[(2-hydroxyethylamino)methyl]-3-pyridinyl]butan-2-one;[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]methanamine;5-(dibenzylamino)pyridine-2-carbonitrile;6-[(2-methoxyethylamino)methyl]pyridin-3-amine;1-[6-[(2-methoxyethylamino)methyl]-3-pyridinyl]propan-2-one;2-methoxy-N-[(5-methyl-2-pyridinyl)methyl]ethanamine;5-methylpyridine-2-carbaldehyde

C142H176Cl3N27O15 — CID 159639029

About 5-aminopyridine-2-carbonitrile;tert-butyl N-[[5-[4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-2-oxobutyl]-2-pyridinyl]methyl]-N-(2-methoxyethyl)carbamate;tert-butyl N-(2-methoxyethyl)-N-[[5-(2-oxopropyl)-2-pyridinyl]methyl]carbamate;4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-1-[6-[(2-hydroxyethylamino)methyl]-3-pyridinyl]butan-2-one;[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]methanamine;5-(dibenzylamino)pyridine-2-carbonitrile;6-[(2-methoxyethylamino)methyl]pyridin-3-amine;1-[6-[(2-methoxyethylamino)methyl]-3-pyridinyl]propan-2-one;2-methoxy-N-[(5-methyl-2-pyridinyl)methyl]ethanamine;5-methylpyridine-2-carbaldehyde

5-aminopyridine-2-carbonitrile;tert-butyl N-[[5-[4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-2-oxobutyl]-2-pyridinyl]methyl]-N-(2-methoxyethyl)carbamate;tert-butyl N-(2-methoxyethyl)-N-[[5-(2-oxopropyl)-2-pyridinyl]methyl]carbamate;4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-1-[6-[(2-hydroxyethylamino)methyl]-3-pyridinyl]butan-2-one;[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]methanamine;5-(dibenzylamino)pyridine-2-carbonitrile;6-[(2-methoxyethylamino)methyl]pyridin-3-amine;1-[6-[(2-methoxyethylamino)methyl]-3-pyridinyl]propan-2-one;2-methoxy-N-[(5-methyl-2-pyridinyl)methyl]ethanamine;5-methylpyridine-2-carbaldehyde (PubChem CID 159639029) has the molecular formula C142H176Cl3N27O15 and a molecular weight of 2607.50 g/mol. Its IUPAC name is 5-aminopyridine-2-carbonitrile;tert-butyl N-[[5-[4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-2-oxobutyl]-2-pyridinyl]methyl]-N-(2-methoxyethyl)carbamate;tert-butyl N-(2-methoxyethyl)-N-[[5-(2-oxopropyl)-2-pyridinyl]methyl]carbamate;4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-1-[6-[(2-hydroxyethylamino)methyl]-3-pyridinyl]butan-2-one;[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]methanamine;5-(dibenzylamino)pyridine-2-carbonitrile;6-[(2-methoxyethylamino)methyl]pyridin-3-amine;1-[6-[(2-methoxyethylamino)methyl]-3-pyridinyl]propan-2-one;2-methoxy-N-[(5-methyl-2-pyridinyl)methyl]ethanamine;5-methylpyridine-2-carbaldehyde.

Molecular Properties

• Compound Name: 5-aminopyridine-2-carbonitrile;tert-butyl N-[[5-[4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-2-oxobutyl]-2-pyridinyl]methyl]-N-(2-methoxyethyl)carbamate;tert-butyl N-(2-methoxyethyl)-N-[[5-(2-oxopropyl)-2-pyridinyl]methyl]carbamate;4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-1-[6-[(2-hydroxyethylamino)methyl]-3-pyridinyl]butan-2-one;[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]methanamine;5-(dibenzylamino)pyridine-2-carbonitrile;6-[(2-methoxyethylamino)methyl]pyridin-3-amine;1-[6-[(2-methoxyethylamino)methyl]-3-pyridinyl]propan-2-one;2-methoxy-N-[(5-methyl-2-pyridinyl)methyl]ethanamine;5-methylpyridine-2-carbaldehyde
• PubChem CID: 159639029
• Molecular Formula: C142H176Cl3N27O15
• Molecular Weight: 2607.50 g/mol
• Exact Mass: 2604.29
• IUPAC Name: 5-aminopyridine-2-carbonitrile;tert-butyl N-[[5-[4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-2-oxobutyl]-2-pyridinyl]methyl]-N-(2-methoxyethyl)carbamate;tert-butyl N-(2-methoxyethyl)-N-[[5-(2-oxopropyl)-2-pyridinyl]methyl]carbamate;4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-1-[6-[(2-hydroxyethylamino)methyl]-3-pyridinyl]butan-2-one;[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]methanamine;5-(dibenzylamino)pyridine-2-carbonitrile;6-[(2-methoxyethylamino)methyl]pyridin-3-amine;1-[6-[(2-methoxyethylamino)methyl]-3-pyridinyl]propan-2-one;2-methoxy-N-[(5-methyl-2-pyridinyl)methyl]ethanamine;5-methylpyridine-2-carbaldehyde
• SMILES: COCCN(Cc1ccc(CC(=O)CCc2cc(C)nn2-c2cccc(Cl)c2)cn1)C(=O)OC(C)(C)C.COCCN(Cc1ccc(CC(C)=O)cn1)C(=O)OC(C)(C)C.COCCNCc1ccc(C)cn1.COCCNCc1ccc(CC(C)=O)cn1.COCCNCc1ccc(N)cn1.Cc1cc(CCC(=O)Cc2ccc(CNCCO)nc2)n(-c2cccc(Cl)c2)n1.Cc1cc(CN)n(-c2cccc(Cl)c2)n1.Cc1ccc(C=O)nc1.N#Cc1ccc(N(Cc2ccccc2)Cc2ccccc2)cn1.N#Cc1ccc(N)cn1
• InChI: InChI=1S/C28H35ClN4O4.C22H25ClN4O2.C20H17N3.C17H26N2O4.C12H18N2O2.C11H12ClN3.C10H16N2O.C9H15N3O.C7H7NO.C6H5N3/c1-20-15-25(33(31-20)24-8-6-7-22(29)17-24)11-12-26(34)16-21-9-10-23(30-18-21)19-32(13-14-36-5)27(35)37-28(2,3)4;1-16-11-21(27(26-16)20-4-2-3-18(23)13-20)7-8-22(29)12-17-5-6-19(25-14-17)15-24-9-10-28;21-13-19-11-12-20(14-22-19)23(15-17-7-3-1-4-8-17)16-18-9-5-2-6-10-18;1-13(20)10-14-6-7-15(18-11-14)12-19(8-9-22-5)16(21)23-17(2,3)4;1-10(15)7-11-3-4-12(14-8-11)9-13-5-6-16-2;1-8-5-11(7-13)15(14-8)10-4-2-3-9(12)6-10;1-9-3-4-10(12-7-9)8-11-5-6-13-2;1-13-5-4-11-7-9-3-2-8(10)6-12-9;1-6-2-3-7(5-9)8-4-6;7-3-6-2-1-5(8)4-9-6/h6-10,15,17-18H,11-14,16,19H2,1-5H3;2-6,11,13-14,24,28H,7-10,12,15H2,1H3;1-12,14H,15-16H2;6-7,11H,8-10,12H2,1-5H3;3-4,8,13H,5-7,9H2,1-2H3;2-6H,7,13H2,1H3;3-4,7,11H,5-6,8H2,1-2H3;2-3,6,11H,4-5,7,10H2,1H3;2-5H,1H3;1-2,4H,8H2
• InChIKey: MQCOGBWAKJZNGS-UHFFFAOYSA-N
• XLogP: 21.67
• TPSA: 557.28 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 40
• Rotatable Bonds: 53
• Heavy Atoms: 187
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2607.50
LogP ≤ 5	21.67
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	40

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-aminopyridine-2-carbonitrile;tert-butyl N-[[5-[4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-2-oxobutyl]-2-pyridinyl]methyl]-N-(2-methoxyethyl)carbamate;tert-butyl N-(2-methoxyethyl)-N-[[5-(2-oxopropyl)-2-pyridinyl]methyl]carbamate;4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-1-[6-[(2-hydroxyethylamino)methyl]-3-pyridinyl]butan-2-one;[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]methanamine;5-(dibenzylamino)pyridine-2-carbonitrile;6-[(2-methoxyethylamino)methyl]pyridin-3-amine;1-[6-[(2-methoxyethylamino)methyl]-3-pyridinyl]propan-2-one;2-methoxy-N-[(5-methyl-2-pyridinyl)methyl]ethanamine;5-methylpyridine-2-carbaldehyde?

The IUPAC name of 5-aminopyridine-2-carbonitrile;tert-butyl N-[[5-[4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-2-oxobutyl]-2-pyridinyl]methyl]-N-(2-methoxyethyl)carbamate;tert-butyl N-(2-methoxyethyl)-N-[[5-(2-oxopropyl)-2-pyridinyl]methyl]carbamate;4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-1-[6-[(2-hydroxyethylamino)methyl]-3-pyridinyl]butan-2-one;[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]methanamine;5-(dibenzylamino)pyridine-2-carbonitrile;6-[(2-methoxyethylamino)methyl]pyridin-3-amine;1-[6-[(2-methoxyethylamino)methyl]-3-pyridinyl]propan-2-one;2-methoxy-N-[(5-methyl-2-pyridinyl)methyl]ethanamine;5-methylpyridine-2-carbaldehyde (CID 159639029) is 5-aminopyridine-2-carbonitrile;tert-butyl N-[[5-[4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-2-oxobutyl]-2-pyridinyl]methyl]-N-(2-methoxyethyl)carbamate;tert-butyl N-(2-methoxyethyl)-N-[[5-(2-oxopropyl)-2-pyridinyl]methyl]carbamate;4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-1-[6-[(2-hydroxyethylamino)methyl]-3-pyridinyl]butan-2-one;[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]methanamine;5-(dibenzylamino)pyridine-2-carbonitrile;6-[(2-methoxyethylamino)methyl]pyridin-3-amine;1-[6-[(2-methoxyethylamino)methyl]-3-pyridinyl]propan-2-one;2-methoxy-N-[(5-methyl-2-pyridinyl)methyl]ethanamine;5-methylpyridine-2-carbaldehyde.

What is the SMILES notation for 5-aminopyridine-2-carbonitrile;tert-butyl N-[[5-[4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-2-oxobutyl]-2-pyridinyl]methyl]-N-(2-methoxyethyl)carbamate;tert-butyl N-(2-methoxyethyl)-N-[[5-(2-oxopropyl)-2-pyridinyl]methyl]carbamate;4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-1-[6-[(2-hydroxyethylamino)methyl]-3-pyridinyl]butan-2-one;[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]methanamine;5-(dibenzylamino)pyridine-2-carbonitrile;6-[(2-methoxyethylamino)methyl]pyridin-3-amine;1-[6-[(2-methoxyethylamino)methyl]-3-pyridinyl]propan-2-one;2-methoxy-N-[(5-methyl-2-pyridinyl)methyl]ethanamine;5-methylpyridine-2-carbaldehyde?

The canonical SMILES for 5-aminopyridine-2-carbonitrile;tert-butyl N-[[5-[4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-2-oxobutyl]-2-pyridinyl]methyl]-N-(2-methoxyethyl)carbamate;tert-butyl N-(2-methoxyethyl)-N-[[5-(2-oxopropyl)-2-pyridinyl]methyl]carbamate;4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-1-[6-[(2-hydroxyethylamino)methyl]-3-pyridinyl]butan-2-one;[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]methanamine;5-(dibenzylamino)pyridine-2-carbonitrile;6-[(2-methoxyethylamino)methyl]pyridin-3-amine;1-[6-[(2-methoxyethylamino)methyl]-3-pyridinyl]propan-2-one;2-methoxy-N-[(5-methyl-2-pyridinyl)methyl]ethanamine;5-methylpyridine-2-carbaldehyde is COCCN(Cc1ccc(CC(=O)CCc2cc(C)nn2-c2cccc(Cl)c2)cn1)C(=O)OC(C)(C)C.COCCN(Cc1ccc(CC(C)=O)cn1)C(=O)OC(C)(C)C.COCCNCc1ccc(C)cn1.COCCNCc1ccc(CC(C)=O)cn1.COCCNCc1ccc(N)cn1.Cc1cc(CCC(=O)Cc2ccc(CNCCO)nc2)n(-c2cccc(Cl)c2)n1.Cc1cc(CN)n(-c2cccc(Cl)c2)n1.Cc1ccc(C=O)nc1.N#Cc1ccc(N(Cc2ccccc2)Cc2ccccc2)cn1.N#Cc1ccc(N)cn1.

What is the InChIKey of 5-aminopyridine-2-carbonitrile;tert-butyl N-[[5-[4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-2-oxobutyl]-2-pyridinyl]methyl]-N-(2-methoxyethyl)carbamate;tert-butyl N-(2-methoxyethyl)-N-[[5-(2-oxopropyl)-2-pyridinyl]methyl]carbamate;4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-1-[6-[(2-hydroxyethylamino)methyl]-3-pyridinyl]butan-2-one;[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]methanamine;5-(dibenzylamino)pyridine-2-carbonitrile;6-[(2-methoxyethylamino)methyl]pyridin-3-amine;1-[6-[(2-methoxyethylamino)methyl]-3-pyridinyl]propan-2-one;2-methoxy-N-[(5-methyl-2-pyridinyl)methyl]ethanamine;5-methylpyridine-2-carbaldehyde?

The InChIKey is MQCOGBWAKJZNGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H35ClN4O4.C22H25ClN4O2.C20H17N3.C17H26N2O4.C12H18N2O2.C11H12ClN3.C10H16N2O.C9H15N3O.C7H7NO.C6H5N3/c1-20-15-25(33(31-20)24-8-6-7-22(29)17-24)11-12-26(34)16-21-9-10-23(30-18-21)19-32(13-14-36-5)27(35)37-28(2,3)4;1-16-11-21(27(26-16)20-4-2-3-18(23)13-20)7-8-22(29)12-17-5-6-19(25-14-17)15-24-9-10-28;21-13-19-11-12-20(14-22-19)23(15-17-7-3-1-4-8-17)16-18-9-5-2-6-10-18;1-13(20)10-14-6-7-15(18-11-14)12-19(8-9-22-5)16(21)23-17(2,3)4;1-10(15)7-11-3-4-12(14-8-11)9-13-5-6-16-2;1-8-5-11(7-13)15(14-8)10-4-2-3-9(12)6-10;1-9-3-4-10(12-7-9)8-11-5-6-13-2;1-13-5-4-11-7-9-3-2-8(10)6-12-9;1-6-2-3-7(5-9)8-4-6;7-3-6-2-1-5(8)4-9-6/h6-10,15,17-18H,11-14,16,19H2,1-5H3;2-6,11,13-14,24,28H,7-10,12,15H2,1H3;1-12,14H,15-16H2;6-7,11H,8-10,12H2,1-5H3;3-4,8,13H,5-7,9H2,1-2H3;2-6H,7,13H2,1H3;3-4,7,11H,5-6,8H2,1-2H3;2-3,6,11H,4-5,7,10H2,1H3;2-5H,1H3;1-2,4H,8H2.

What are the key properties of 5-aminopyridine-2-carbonitrile;tert-butyl N-[[5-[4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-2-oxobutyl]-2-pyridinyl]methyl]-N-(2-methoxyethyl)carbamate;tert-butyl N-(2-methoxyethyl)-N-[[5-(2-oxopropyl)-2-pyridinyl]methyl]carbamate;4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-1-[6-[(2-hydroxyethylamino)methyl]-3-pyridinyl]butan-2-one;[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]methanamine;5-(dibenzylamino)pyridine-2-carbonitrile;6-[(2-methoxyethylamino)methyl]pyridin-3-amine;1-[6-[(2-methoxyethylamino)methyl]-3-pyridinyl]propan-2-one;2-methoxy-N-[(5-methyl-2-pyridinyl)methyl]ethanamine;5-methylpyridine-2-carbaldehyde?

5-aminopyridine-2-carbonitrile;tert-butyl N-[[5-[4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-2-oxobutyl]-2-pyridinyl]methyl]-N-(2-methoxyethyl)carbamate;tert-butyl N-(2-methoxyethyl)-N-[[5-(2-oxopropyl)-2-pyridinyl]methyl]carbamate;4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-1-[6-[(2-hydroxyethylamino)methyl]-3-pyridinyl]butan-2-one;[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]methanamine;5-(dibenzylamino)pyridine-2-carbonitrile;6-[(2-methoxyethylamino)methyl]pyridin-3-amine;1-[6-[(2-methoxyethylamino)methyl]-3-pyridinyl]propan-2-one;2-methoxy-N-[(5-methyl-2-pyridinyl)methyl]ethanamine;5-methylpyridine-2-carbaldehyde has a molecular weight of 2607.50 g/mol, XLogP of 21.67, 53 rotatable bonds, 8 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for 5-aminopyridine-2-carbonitrile;tert-butyl N-[[5-[4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-2-oxobutyl]-2-pyridinyl]methyl]-N-(2-methoxyethyl)carbamate;tert-butyl N-(2-methoxyethyl)-N-[[5-(2-oxopropyl)-2-pyridinyl]methyl]carbamate;4-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-1-[6-[(2-hydroxyethylamino)methyl]-3-pyridinyl]butan-2-one;[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]methanamine;5-(dibenzylamino)pyridine-2-carbonitrile;6-[(2-methoxyethylamino)methyl]pyridin-3-amine;1-[6-[(2-methoxyethylamino)methyl]-3-pyridinyl]propan-2-one;2-methoxy-N-[(5-methyl-2-pyridinyl)methyl]ethanamine;5-methylpyridine-2-carbaldehyde is sourced from PubChem (CID 159639029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).