4-(4-chlorophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-cyclohexyl-N-(5-methyl-2-pyridinyl)benzamide;4-(4-hydroxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-isocyanophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-methoxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;3-methyl-N-(5-methyl-2-pyridinyl)but-2-enamide;N-(5-methyl-2-pyridinyl)naphthalene-1-carboxamide;N-(5-methyl-2-pyridinyl)-2-phenylacetamide

C139H128ClN17O10 — CID 160790776

IUPAC4-(4-chlorophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-cyclohexyl-N-(5-methyl-2-pyridinyl)benzamide;4-(4-hydroxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-isocyanophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-methoxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;3-methyl-N-(5-methyl-2-pyridinyl)but-2-enamide;N-(5-methyl-2-pyridinyl)naphthalene-1-carboxamide;N-(5-methyl-2-pyridinyl)-2-phenylacetamide
SMILESCC(C)=CC(=O)Nc1ccc(C)cn1.COc1ccc(-c2ccc(C(=O)Nc3ccc(C)cn3)cc2)cc1.Cc1ccc(NC(=O)Cc2ccccc2)nc1.Cc1ccc(NC(=O)c2ccc(-c3ccc(Cl)cc3)cc2)nc1.Cc1ccc(NC(=O)c2ccc(-c3ccc(O)cc3)cc2)nc1.Cc1ccc(NC(=O)c2ccc(C3CCCCC3)cc2)nc1.Cc1ccc(NC(=O)c2cccc3ccccc23)nc1.[C-]#[N+]c1ccc(-c2ccc(C(=O)Nc3ccc(C)cn3)cc2)cc1
InChIInChI=1S/C20H15N3O.C20H18N2O2.C19H15ClN2O.C19H16N2O2.C19H22N2O.C17H14N2O.C14H14N2O.C11H14N2O/c1-14-3-12-19(22-13-14)23-20(24)17-6-4-15(5-7-17)16-8-10-18(21-2)11-9-16;1-14-3-12-19(21-13-14)22-20(23)17-6-4-15(5-7-17)16-8-10-18(24-2)11-9-16;1-13-2-11-18(21-12-13)22-19(23)16-5-3-14(4-6-16)15-7-9-17(20)10-8-15;1-13-2-11-18(20-12-13)21-19(23)16-5-3-14(4-6-16)15-7-9-17(22)10-8-15;1-14-7-12-18(20-13-14)21-19(22)17-10-8-16(9-11-17)15-5-3-2-4-6-15;1-12-9-10-16(18-11-12)19-17(20)15-8-4-6-13-5-2-3-7-14(13)15;1-11-7-8-13(15-10-11)16-14(17)9-12-5-3-2-4-6-12;1-8(2)6-11(14)13-10-5-4-9(3)7-12-10/h3-13H,1H3,(H,22,23,24);3-13H,1-2H3,(H,21,22,23);2-12H,1H3,(H,21,22,23);2-12,22H,1H3,(H,20,21,23);7-13,15H,2-6H2,1H3,(H,20,21,22);2-11H,1H3,(H,18,19,20);2-8,10H,9H2,1H3,(H,15,16,17);4-7H,1-3H3,(H,12,13,14)
InChIKeySBUJTCQEKZANIW-UHFFFAOYSA-N
MW2232.11 g/mol
LogP31.51
Rot. Bonds23

About 4-(4-chlorophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-cyclohexyl-N-(5-methyl-2-pyridinyl)benzamide;4-(4-hydroxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-isocyanophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-methoxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;3-methyl-N-(5-methyl-2-pyridinyl)but-2-enamide;N-(5-methyl-2-pyridinyl)naphthalene-1-carboxamide;N-(5-methyl-2-pyridinyl)-2-phenylacetamide

4-(4-chlorophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-cyclohexyl-N-(5-methyl-2-pyridinyl)benzamide;4-(4-hydroxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-isocyanophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-methoxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;3-methyl-N-(5-methyl-2-pyridinyl)but-2-enamide;N-(5-methyl-2-pyridinyl)naphthalene-1-carboxamide;N-(5-methyl-2-pyridinyl)-2-phenylacetamide (PubChem CID 160790776) has the molecular formula C139H128ClN17O10 and a molecular weight of 2232.11 g/mol. Its IUPAC name is 4-(4-chlorophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-cyclohexyl-N-(5-methyl-2-pyridinyl)benzamide;4-(4-hydroxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-isocyanophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-methoxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;3-methyl-N-(5-methyl-2-pyridinyl)but-2-enamide;N-(5-methyl-2-pyridinyl)naphthalene-1-carboxamide;N-(5-methyl-2-pyridinyl)-2-phenylacetamide.

Molecular Properties

Compound Name4-(4-chlorophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-cyclohexyl-N-(5-methyl-2-pyridinyl)benzamide;4-(4-hydroxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-isocyanophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-methoxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;3-methyl-N-(5-methyl-2-pyridinyl)but-2-enamide;N-(5-methyl-2-pyridinyl)naphthalene-1-carboxamide;N-(5-methyl-2-pyridinyl)-2-phenylacetamide
PubChem CID160790776
Molecular FormulaC139H128ClN17O10
Molecular Weight2232.11 g/mol
Exact Mass2229.97
IUPAC Name4-(4-chlorophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-cyclohexyl-N-(5-methyl-2-pyridinyl)benzamide;4-(4-hydroxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-isocyanophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-methoxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;3-methyl-N-(5-methyl-2-pyridinyl)but-2-enamide;N-(5-methyl-2-pyridinyl)naphthalene-1-carboxamide;N-(5-methyl-2-pyridinyl)-2-phenylacetamide
SMILESCC(C)=CC(=O)Nc1ccc(C)cn1.COc1ccc(-c2ccc(C(=O)Nc3ccc(C)cn3)cc2)cc1.Cc1ccc(NC(=O)Cc2ccccc2)nc1.Cc1ccc(NC(=O)c2ccc(-c3ccc(Cl)cc3)cc2)nc1.Cc1ccc(NC(=O)c2ccc(-c3ccc(O)cc3)cc2)nc1.Cc1ccc(NC(=O)c2ccc(C3CCCCC3)cc2)nc1.Cc1ccc(NC(=O)c2cccc3ccccc23)nc1.[C-]#[N+]c1ccc(-c2ccc(C(=O)Nc3ccc(C)cn3)cc2)cc1
InChIInChI=1S/C20H15N3O.C20H18N2O2.C19H15ClN2O.C19H16N2O2.C19H22N2O.C17H14N2O.C14H14N2O.C11H14N2O/c1-14-3-12-19(22-13-14)23-20(24)17-6-4-15(5-7-17)16-8-10-18(21-2)11-9-16;1-14-3-12-19(21-13-14)22-20(23)17-6-4-15(5-7-17)16-8-10-18(24-2)11-9-16;1-13-2-11-18(21-12-13)22-19(23)16-5-3-14(4-6-16)15-7-9-17(20)10-8-15;1-13-2-11-18(20-12-13)21-19(23)16-5-3-14(4-6-16)15-7-9-17(22)10-8-15;1-14-7-12-18(20-13-14)21-19(22)17-10-8-16(9-11-17)15-5-3-2-4-6-15;1-12-9-10-16(18-11-12)19-17(20)15-8-4-6-13-5-2-3-7-14(13)15;1-11-7-8-13(15-10-11)16-14(17)9-12-5-3-2-4-6-12;1-8(2)6-11(14)13-10-5-4-9(3)7-12-10/h3-13H,1H3,(H,22,23,24);3-13H,1-2H3,(H,21,22,23);2-12H,1H3,(H,21,22,23);2-12,22H,1H3,(H,20,21,23);7-13,15H,2-6H2,1H3,(H,20,21,22);2-11H,1H3,(H,18,19,20);2-8,10H,9H2,1H3,(H,15,16,17);4-7H,1-3H3,(H,12,13,14)
InChIKeySBUJTCQEKZANIW-UHFFFAOYSA-N
XLogP31.51
TPSA369.74 Ų
H-Bond Donors9
H-Bond Acceptors18
Rotatable Bonds23
Heavy Atoms167
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002232.11
LogP ≤ 531.51
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 4-(4-chlorophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-cyclohexyl-N-(5-methyl-2-pyridinyl)benzamide;4-(4-hydroxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-isocyanophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-methoxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;3-methyl-N-(5-methyl-2-pyridinyl)but-2-enamide;N-(5-methyl-2-pyridinyl)naphthalene-1-carboxamide;N-(5-methyl-2-pyridinyl)-2-phenylacetamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-cyclohexyl-N-(5-methyl-2-pyridinyl)benzamide;4-(4-hydroxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-isocyanophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-methoxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;3-methyl-N-(5-methyl-2-pyridinyl)but-2-enamide;N-(5-methyl-2-pyridinyl)naphthalene-1-carboxamide;N-(5-methyl-2-pyridinyl)-2-phenylacetamide?
The IUPAC name of 4-(4-chlorophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-cyclohexyl-N-(5-methyl-2-pyridinyl)benzamide;4-(4-hydroxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-isocyanophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-methoxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;3-methyl-N-(5-methyl-2-pyridinyl)but-2-enamide;N-(5-methyl-2-pyridinyl)naphthalene-1-carboxamide;N-(5-methyl-2-pyridinyl)-2-phenylacetamide (CID 160790776) is 4-(4-chlorophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-cyclohexyl-N-(5-methyl-2-pyridinyl)benzamide;4-(4-hydroxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-isocyanophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-methoxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;3-methyl-N-(5-methyl-2-pyridinyl)but-2-enamide;N-(5-methyl-2-pyridinyl)naphthalene-1-carboxamide;N-(5-methyl-2-pyridinyl)-2-phenylacetamide.
What is the SMILES notation for 4-(4-chlorophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-cyclohexyl-N-(5-methyl-2-pyridinyl)benzamide;4-(4-hydroxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-isocyanophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-methoxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;3-methyl-N-(5-methyl-2-pyridinyl)but-2-enamide;N-(5-methyl-2-pyridinyl)naphthalene-1-carboxamide;N-(5-methyl-2-pyridinyl)-2-phenylacetamide?
The canonical SMILES for 4-(4-chlorophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-cyclohexyl-N-(5-methyl-2-pyridinyl)benzamide;4-(4-hydroxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-isocyanophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-methoxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;3-methyl-N-(5-methyl-2-pyridinyl)but-2-enamide;N-(5-methyl-2-pyridinyl)naphthalene-1-carboxamide;N-(5-methyl-2-pyridinyl)-2-phenylacetamide is CC(C)=CC(=O)Nc1ccc(C)cn1.COc1ccc(-c2ccc(C(=O)Nc3ccc(C)cn3)cc2)cc1.Cc1ccc(NC(=O)Cc2ccccc2)nc1.Cc1ccc(NC(=O)c2ccc(-c3ccc(Cl)cc3)cc2)nc1.Cc1ccc(NC(=O)c2ccc(-c3ccc(O)cc3)cc2)nc1.Cc1ccc(NC(=O)c2ccc(C3CCCCC3)cc2)nc1.Cc1ccc(NC(=O)c2cccc3ccccc23)nc1.[C-]#[N+]c1ccc(-c2ccc(C(=O)Nc3ccc(C)cn3)cc2)cc1.
What is the InChIKey of 4-(4-chlorophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-cyclohexyl-N-(5-methyl-2-pyridinyl)benzamide;4-(4-hydroxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-isocyanophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-methoxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;3-methyl-N-(5-methyl-2-pyridinyl)but-2-enamide;N-(5-methyl-2-pyridinyl)naphthalene-1-carboxamide;N-(5-methyl-2-pyridinyl)-2-phenylacetamide?
The InChIKey is SBUJTCQEKZANIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3O.C20H18N2O2.C19H15ClN2O.C19H16N2O2.C19H22N2O.C17H14N2O.C14H14N2O.C11H14N2O/c1-14-3-12-19(22-13-14)23-20(24)17-6-4-15(5-7-17)16-8-10-18(21-2)11-9-16;1-14-3-12-19(21-13-14)22-20(23)17-6-4-15(5-7-17)16-8-10-18(24-2)11-9-16;1-13-2-11-18(21-12-13)22-19(23)16-5-3-14(4-6-16)15-7-9-17(20)10-8-15;1-13-2-11-18(20-12-13)21-19(23)16-5-3-14(4-6-16)15-7-9-17(22)10-8-15;1-14-7-12-18(20-13-14)21-19(22)17-10-8-16(9-11-17)15-5-3-2-4-6-15;1-12-9-10-16(18-11-12)19-17(20)15-8-4-6-13-5-2-3-7-14(13)15;1-11-7-8-13(15-10-11)16-14(17)9-12-5-3-2-4-6-12;1-8(2)6-11(14)13-10-5-4-9(3)7-12-10/h3-13H,1H3,(H,22,23,24);3-13H,1-2H3,(H,21,22,23);2-12H,1H3,(H,21,22,23);2-12,22H,1H3,(H,20,21,23);7-13,15H,2-6H2,1H3,(H,20,21,22);2-11H,1H3,(H,18,19,20);2-8,10H,9H2,1H3,(H,15,16,17);4-7H,1-3H3,(H,12,13,14).
What are the key properties of 4-(4-chlorophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-cyclohexyl-N-(5-methyl-2-pyridinyl)benzamide;4-(4-hydroxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-isocyanophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-methoxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;3-methyl-N-(5-methyl-2-pyridinyl)but-2-enamide;N-(5-methyl-2-pyridinyl)naphthalene-1-carboxamide;N-(5-methyl-2-pyridinyl)-2-phenylacetamide?
4-(4-chlorophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-cyclohexyl-N-(5-methyl-2-pyridinyl)benzamide;4-(4-hydroxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-isocyanophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-methoxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;3-methyl-N-(5-methyl-2-pyridinyl)but-2-enamide;N-(5-methyl-2-pyridinyl)naphthalene-1-carboxamide;N-(5-methyl-2-pyridinyl)-2-phenylacetamide has a molecular weight of 2232.11 g/mol, XLogP of 31.51, 23 rotatable bonds, 9 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-cyclohexyl-N-(5-methyl-2-pyridinyl)benzamide;4-(4-hydroxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-isocyanophenyl)-N-(5-methyl-2-pyridinyl)benzamide;4-(4-methoxyphenyl)-N-(5-methyl-2-pyridinyl)benzamide;3-methyl-N-(5-methyl-2-pyridinyl)but-2-enamide;N-(5-methyl-2-pyridinyl)naphthalene-1-carboxamide;N-(5-methyl-2-pyridinyl)-2-phenylacetamide is sourced from PubChem (CID 160790776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).