6-(2-methoxyethylamino)-N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]pyridine-3-carboxamide;N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]-6-piperidin-1-ylpyridine-3-carboxamide

C60H70N8O7 — CID 87728210

IUPAC6-(2-methoxyethylamino)-N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]pyridine-3-carboxamide;N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]-6-piperidin-1-ylpyridine-3-carboxamide
SMILESCOCCNc1ccc(C(=O)Nc2cc(C(=O)N3CCC(c4ccc(OC)cc4)CC3)ccc2C)cn1.COc1ccc(C2CCN(C(=O)c3ccc(C)c(NC(=O)c4ccc(N5CCCCC5)nc4)c3)CC2)cc1
InChIInChI=1S/C31H36N4O3.C29H34N4O4/c1-22-6-7-25(31(37)35-18-14-24(15-19-35)23-8-11-27(38-2)12-9-23)20-28(22)33-30(36)26-10-13-29(32-21-26)34-16-4-3-5-17-34;1-20-4-5-23(18-26(20)32-28(34)24-8-11-27(31-19-24)30-14-17-36-2)29(35)33-15-12-22(13-16-33)21-6-9-25(37-3)10-7-21/h6-13,20-21,24H,3-5,14-19H2,1-2H3,(H,33,36);4-11,18-19,22H,12-17H2,1-3H3,(H,30,31)(H,32,34)
InChIKeyXCJIQXKAEDMDRO-UHFFFAOYSA-N
MW1015.27 g/mol
LogP10.39
Rot. Bonds15

About 6-(2-methoxyethylamino)-N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]pyridine-3-carboxamide;N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]-6-piperidin-1-ylpyridine-3-carboxamide

6-(2-methoxyethylamino)-N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]pyridine-3-carboxamide;N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]-6-piperidin-1-ylpyridine-3-carboxamide (PubChem CID 87728210) has the molecular formula C60H70N8O7 and a molecular weight of 1015.27 g/mol. Its IUPAC name is 6-(2-methoxyethylamino)-N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]pyridine-3-carboxamide;N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]-6-piperidin-1-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-(2-methoxyethylamino)-N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]pyridine-3-carboxamide;N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]-6-piperidin-1-ylpyridine-3-carboxamide
PubChem CID87728210
Molecular FormulaC60H70N8O7
Molecular Weight1015.27 g/mol
Exact Mass1014.54
IUPAC Name6-(2-methoxyethylamino)-N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]pyridine-3-carboxamide;N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]-6-piperidin-1-ylpyridine-3-carboxamide
SMILESCOCCNc1ccc(C(=O)Nc2cc(C(=O)N3CCC(c4ccc(OC)cc4)CC3)ccc2C)cn1.COc1ccc(C2CCN(C(=O)c3ccc(C)c(NC(=O)c4ccc(N5CCCCC5)nc4)c3)CC2)cc1
InChIInChI=1S/C31H36N4O3.C29H34N4O4/c1-22-6-7-25(31(37)35-18-14-24(15-19-35)23-8-11-27(38-2)12-9-23)20-28(22)33-30(36)26-10-13-29(32-21-26)34-16-4-3-5-17-34;1-20-4-5-23(18-26(20)32-28(34)24-8-11-27(31-19-24)30-14-17-36-2)29(35)33-15-12-22(13-16-33)21-6-9-25(37-3)10-7-21/h6-13,20-21,24H,3-5,14-19H2,1-2H3,(H,33,36);4-11,18-19,22H,12-17H2,1-3H3,(H,30,31)(H,32,34)
InChIKeyXCJIQXKAEDMDRO-UHFFFAOYSA-N
XLogP10.39
TPSA167.56 Ų
H-Bond Donors3
H-Bond Acceptors11
Rotatable Bonds15
Heavy Atoms75
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001015.27
LogP ≤ 510.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

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

Analyze 6-(2-methoxyethylamino)-N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]pyridine-3-carboxamide;N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]-6-piperidin-1-ylpyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(2-methoxyethylamino)-N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]pyridine-3-carboxamide;N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]-6-piperidin-1-ylpyridine-3-carboxamide?
The IUPAC name of 6-(2-methoxyethylamino)-N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]pyridine-3-carboxamide;N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]-6-piperidin-1-ylpyridine-3-carboxamide (CID 87728210) is 6-(2-methoxyethylamino)-N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]pyridine-3-carboxamide;N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]-6-piperidin-1-ylpyridine-3-carboxamide.
What is the SMILES notation for 6-(2-methoxyethylamino)-N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]pyridine-3-carboxamide;N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]-6-piperidin-1-ylpyridine-3-carboxamide?
The canonical SMILES for 6-(2-methoxyethylamino)-N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]pyridine-3-carboxamide;N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]-6-piperidin-1-ylpyridine-3-carboxamide is COCCNc1ccc(C(=O)Nc2cc(C(=O)N3CCC(c4ccc(OC)cc4)CC3)ccc2C)cn1.COc1ccc(C2CCN(C(=O)c3ccc(C)c(NC(=O)c4ccc(N5CCCCC5)nc4)c3)CC2)cc1.
What is the InChIKey of 6-(2-methoxyethylamino)-N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]pyridine-3-carboxamide;N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]-6-piperidin-1-ylpyridine-3-carboxamide?
The InChIKey is XCJIQXKAEDMDRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H36N4O3.C29H34N4O4/c1-22-6-7-25(31(37)35-18-14-24(15-19-35)23-8-11-27(38-2)12-9-23)20-28(22)33-30(36)26-10-13-29(32-21-26)34-16-4-3-5-17-34;1-20-4-5-23(18-26(20)32-28(34)24-8-11-27(31-19-24)30-14-17-36-2)29(35)33-15-12-22(13-16-33)21-6-9-25(37-3)10-7-21/h6-13,20-21,24H,3-5,14-19H2,1-2H3,(H,33,36);4-11,18-19,22H,12-17H2,1-3H3,(H,30,31)(H,32,34).
What are the key properties of 6-(2-methoxyethylamino)-N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]pyridine-3-carboxamide;N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]-6-piperidin-1-ylpyridine-3-carboxamide?
6-(2-methoxyethylamino)-N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]pyridine-3-carboxamide;N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]-6-piperidin-1-ylpyridine-3-carboxamide has a molecular weight of 1015.27 g/mol, XLogP of 10.39, 15 rotatable bonds, 3 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxyethylamino)-N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]pyridine-3-carboxamide;N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]-6-piperidin-1-ylpyridine-3-carboxamide is sourced from PubChem (CID 87728210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).