N-hydroxy-2-[2-methyl-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[(naphthalen-2-ylsulfonylamino)methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[3-[(naphthalen-2-ylsulfonylamino)methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylbenzoyl)amino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[(2S)-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide

C131H138N30O28S5 — CID 157429255

IUPACN-hydroxy-2-[2-methyl-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[(naphthalen-2-ylsulfonylamino)methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[3-[(naphthalen-2-ylsulfonylamino)methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylbenzoyl)amino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[(2S)-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide
SMILESCC1(CNS(=O)(=O)c2ccc(-c3ccccc3)cc2)CN(c2ncc(C(=O)NO)cn2)CCO1.O=C(NO)c1cnc(N2CCCC(CNS(=O)(=O)c3ccc4ccccc4c3)C2)nc1.O=C(NO)c1cnc(N2CCOC(CNC(=O)c3ccc(-c4ccccc4)cc3)C2)nc1.O=C(NO)c1cnc(N2CCOC(CNS(=O)(=O)c3ccc(-c4ccccc4)cc3)C2)nc1.O=C(NO)c1cnc(N2CCOC(CNS(=O)(=O)c3ccc4ccccc4c3)C2)nc1.O=C(NO)c1cnc(N2CCO[C@H](CNS(=O)(=O)c3ccc(-c4ccccc4)cc3)C2)nc1
InChIInChI=1S/C23H25N5O5S.C23H23N5O4.2C22H23N5O5S.C21H23N5O4S.C20H21N5O5S/c1-23(16-28(11-12-33-23)22-24-13-19(14-25-22)21(29)27-30)15-26-34(31,32)20-9-7-18(8-10-20)17-5-3-2-4-6-17;29-21(18-8-6-17(7-9-18)16-4-2-1-3-5-16)24-14-20-15-28(10-11-32-20)23-25-12-19(13-26-23)22(30)27-31;2*28-21(26-29)18-12-23-22(24-13-18)27-10-11-32-19(15-27)14-25-33(30,31)20-8-6-17(7-9-20)16-4-2-1-3-5-16;27-20(25-28)18-12-22-21(23-13-18)26-9-3-4-15(14-26)11-24-31(29,30)19-8-7-16-5-1-2-6-17(16)10-19;26-19(24-27)16-10-21-20(22-11-16)25-7-8-30-17(13-25)12-23-31(28,29)18-6-5-14-3-1-2-4-15(14)9-18/h2-10,13-14,26,30H,11-12,15-16H2,1H3,(H,27,29);1-9,12-13,20,31H,10-11,14-15H2,(H,24,29)(H,27,30);2*1-9,12-13,19,25,29H,10-11,14-15H2,(H,26,28);1-2,5-8,10,12-13,15,24,28H,3-4,9,11,14H2,(H,25,27);1-6,9-11,17,23,27H,7-8,12-13H2,(H,24,26)/t;;19-;;;/m..1.../s1
InChIKeyBQIKIVHWPNSUEF-UJVMLZJTSA-N
MW2741.06 g/mol
LogP9.50
Rot. Bonds39

About N-hydroxy-2-[2-methyl-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[(naphthalen-2-ylsulfonylamino)methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[3-[(naphthalen-2-ylsulfonylamino)methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylbenzoyl)amino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[(2S)-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide

N-hydroxy-2-[2-methyl-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[(naphthalen-2-ylsulfonylamino)methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[3-[(naphthalen-2-ylsulfonylamino)methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylbenzoyl)amino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[(2S)-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide (PubChem CID 157429255) has the molecular formula C131H138N30O28S5 and a molecular weight of 2741.06 g/mol. Its IUPAC name is N-hydroxy-2-[2-methyl-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[(naphthalen-2-ylsulfonylamino)methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[3-[(naphthalen-2-ylsulfonylamino)methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylbenzoyl)amino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[(2S)-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-hydroxy-2-[2-methyl-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[(naphthalen-2-ylsulfonylamino)methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[3-[(naphthalen-2-ylsulfonylamino)methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylbenzoyl)amino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[(2S)-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide
PubChem CID157429255
Molecular FormulaC131H138N30O28S5
Molecular Weight2741.06 g/mol
Exact Mass2738.89
IUPAC NameN-hydroxy-2-[2-methyl-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[(naphthalen-2-ylsulfonylamino)methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[3-[(naphthalen-2-ylsulfonylamino)methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylbenzoyl)amino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[(2S)-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide
SMILESCC1(CNS(=O)(=O)c2ccc(-c3ccccc3)cc2)CN(c2ncc(C(=O)NO)cn2)CCO1.O=C(NO)c1cnc(N2CCCC(CNS(=O)(=O)c3ccc4ccccc4c3)C2)nc1.O=C(NO)c1cnc(N2CCOC(CNC(=O)c3ccc(-c4ccccc4)cc3)C2)nc1.O=C(NO)c1cnc(N2CCOC(CNS(=O)(=O)c3ccc(-c4ccccc4)cc3)C2)nc1.O=C(NO)c1cnc(N2CCOC(CNS(=O)(=O)c3ccc4ccccc4c3)C2)nc1.O=C(NO)c1cnc(N2CCO[C@H](CNS(=O)(=O)c3ccc(-c4ccccc4)cc3)C2)nc1
InChIInChI=1S/C23H25N5O5S.C23H23N5O4.2C22H23N5O5S.C21H23N5O4S.C20H21N5O5S/c1-23(16-28(11-12-33-23)22-24-13-19(14-25-22)21(29)27-30)15-26-34(31,32)20-9-7-18(8-10-20)17-5-3-2-4-6-17;29-21(18-8-6-17(7-9-18)16-4-2-1-3-5-16)24-14-20-15-28(10-11-32-20)23-25-12-19(13-26-23)22(30)27-31;2*28-21(26-29)18-12-23-22(24-13-18)27-10-11-32-19(15-27)14-25-33(30,31)20-8-6-17(7-9-20)16-4-2-1-3-5-16;27-20(25-28)18-12-22-21(23-13-18)26-9-3-4-15(14-26)11-24-31(29,30)19-8-7-16-5-1-2-6-17(16)10-19;26-19(24-27)16-10-21-20(22-11-16)25-7-8-30-17(13-25)12-23-31(28,29)18-6-5-14-3-1-2-4-15(14)9-18/h2-10,13-14,26,30H,11-12,15-16H2,1H3,(H,27,29);1-9,12-13,20,31H,10-11,14-15H2,(H,24,29)(H,27,30);2*1-9,12-13,19,25,29H,10-11,14-15H2,(H,26,28);1-2,5-8,10,12-13,15,24,28H,3-4,9,11,14H2,(H,25,27);1-6,9-11,17,23,27H,7-8,12-13H2,(H,24,26)/t;;19-;;;/m..1.../s1
InChIKeyBQIKIVHWPNSUEF-UJVMLZJTSA-N
XLogP9.50
TPSA776.20 Ų
H-Bond Donors18
H-Bond Acceptors46
Rotatable Bonds39
Heavy Atoms194
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002741.06
LogP ≤ 59.50
H-Bond Donors ≤ 518
H-Bond Acceptors ≤ 1046

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-hydroxy-2-[2-methyl-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[(naphthalen-2-ylsulfonylamino)methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[3-[(naphthalen-2-ylsulfonylamino)methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylbenzoyl)amino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[(2S)-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-[2-methyl-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[(naphthalen-2-ylsulfonylamino)methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[3-[(naphthalen-2-ylsulfonylamino)methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylbenzoyl)amino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[(2S)-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide?
The IUPAC name of N-hydroxy-2-[2-methyl-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[(naphthalen-2-ylsulfonylamino)methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[3-[(naphthalen-2-ylsulfonylamino)methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylbenzoyl)amino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[(2S)-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide (CID 157429255) is N-hydroxy-2-[2-methyl-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[(naphthalen-2-ylsulfonylamino)methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[3-[(naphthalen-2-ylsulfonylamino)methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylbenzoyl)amino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[(2S)-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide.
What is the SMILES notation for N-hydroxy-2-[2-methyl-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[(naphthalen-2-ylsulfonylamino)methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[3-[(naphthalen-2-ylsulfonylamino)methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylbenzoyl)amino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[(2S)-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide?
The canonical SMILES for N-hydroxy-2-[2-methyl-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[(naphthalen-2-ylsulfonylamino)methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[3-[(naphthalen-2-ylsulfonylamino)methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylbenzoyl)amino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[(2S)-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide is CC1(CNS(=O)(=O)c2ccc(-c3ccccc3)cc2)CN(c2ncc(C(=O)NO)cn2)CCO1.O=C(NO)c1cnc(N2CCCC(CNS(=O)(=O)c3ccc4ccccc4c3)C2)nc1.O=C(NO)c1cnc(N2CCOC(CNC(=O)c3ccc(-c4ccccc4)cc3)C2)nc1.O=C(NO)c1cnc(N2CCOC(CNS(=O)(=O)c3ccc(-c4ccccc4)cc3)C2)nc1.O=C(NO)c1cnc(N2CCOC(CNS(=O)(=O)c3ccc4ccccc4c3)C2)nc1.O=C(NO)c1cnc(N2CCO[C@H](CNS(=O)(=O)c3ccc(-c4ccccc4)cc3)C2)nc1.
What is the InChIKey of N-hydroxy-2-[2-methyl-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[(naphthalen-2-ylsulfonylamino)methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[3-[(naphthalen-2-ylsulfonylamino)methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylbenzoyl)amino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[(2S)-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide?
The InChIKey is BQIKIVHWPNSUEF-UJVMLZJTSA-N. The full InChI is InChI=1S/C23H25N5O5S.C23H23N5O4.2C22H23N5O5S.C21H23N5O4S.C20H21N5O5S/c1-23(16-28(11-12-33-23)22-24-13-19(14-25-22)21(29)27-30)15-26-34(31,32)20-9-7-18(8-10-20)17-5-3-2-4-6-17;29-21(18-8-6-17(7-9-18)16-4-2-1-3-5-16)24-14-20-15-28(10-11-32-20)23-25-12-19(13-26-23)22(30)27-31;2*28-21(26-29)18-12-23-22(24-13-18)27-10-11-32-19(15-27)14-25-33(30,31)20-8-6-17(7-9-20)16-4-2-1-3-5-16;27-20(25-28)18-12-22-21(23-13-18)26-9-3-4-15(14-26)11-24-31(29,30)19-8-7-16-5-1-2-6-17(16)10-19;26-19(24-27)16-10-21-20(22-11-16)25-7-8-30-17(13-25)12-23-31(28,29)18-6-5-14-3-1-2-4-15(14)9-18/h2-10,13-14,26,30H,11-12,15-16H2,1H3,(H,27,29);1-9,12-13,20,31H,10-11,14-15H2,(H,24,29)(H,27,30);2*1-9,12-13,19,25,29H,10-11,14-15H2,(H,26,28);1-2,5-8,10,12-13,15,24,28H,3-4,9,11,14H2,(H,25,27);1-6,9-11,17,23,27H,7-8,12-13H2,(H,24,26)/t;;19-;;;/m..1.../s1.
What are the key properties of N-hydroxy-2-[2-methyl-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[(naphthalen-2-ylsulfonylamino)methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[3-[(naphthalen-2-ylsulfonylamino)methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylbenzoyl)amino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[(2S)-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide?
N-hydroxy-2-[2-methyl-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[(naphthalen-2-ylsulfonylamino)methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[3-[(naphthalen-2-ylsulfonylamino)methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylbenzoyl)amino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[(2S)-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide has a molecular weight of 2741.06 g/mol, XLogP of 9.50, 39 rotatable bonds, 18 hydrogen bond donors, and 46 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-[2-methyl-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[(naphthalen-2-ylsulfonylamino)methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[3-[(naphthalen-2-ylsulfonylamino)methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylbenzoyl)amino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[(2S)-2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[2-[[(4-phenylphenyl)sulfonylamino]methyl]morpholin-4-yl]pyrimidine-5-carboxamide is sourced from PubChem (CID 157429255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).