4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-methylnaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-methylphenyl)naphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxynaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide

C74H51N25O10 — CID 160654883

IUPAC4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-methylnaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-methylphenyl)naphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxynaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide
SMILESCNC(=O)c1cc2ccccc2c(/N=N/c2[nH]ncc2C#N)c1O.Cc1cccc(NC(=O)c2cc3ccccc3c(/N=N/c3[nH]ncc3C#N)c2O)c1.N#Cc1cn[nH]c1/N=N/c1c(O)c(C(=O)Nc2cccc([N+](=O)[O-])c2)cc2ccccc12.N#Cc1cn[nH]c1/N=N/c1c(O)c(C(N)=O)cc2ccccc12
InChIInChI=1S/C22H16N6O2.C21H13N7O4.C16H12N6O2.C15H10N6O2/c1-13-5-4-7-16(9-13)25-22(30)18-10-14-6-2-3-8-17(14)19(20(18)29)26-28-21-15(11-23)12-24-27-21;22-10-13-11-23-26-20(13)27-25-18-16-7-2-1-4-12(16)8-17(19(18)29)21(30)24-14-5-3-6-15(9-14)28(31)32;1-18-16(24)12-6-9-4-2-3-5-11(9)13(14(12)23)20-22-15-10(7-17)8-19-21-15;16-6-9-7-18-20-15(9)21-19-12-10-4-2-1-3-8(10)5-11(13(12)22)14(17)23/h2-10,12,29H,1H3,(H,24,27)(H,25,30);1-9,11,29H,(H,23,26)(H,24,30);2-6,8,23H,1H3,(H,18,24)(H,19,21);1-5,7,22H,(H2,17,23)(H,18,20)/b28-26+;27-25+;22-20+;21-19+
InChIKeyRKXJDIBXLCGWND-LJOCVEJBSA-N
MW1450.39 g/mol
LogP15.40
Rot. Bonds15

About 4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-methylnaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-methylphenyl)naphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxynaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide

4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-methylnaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-methylphenyl)naphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxynaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide (PubChem CID 160654883) has the molecular formula C74H51N25O10 and a molecular weight of 1450.39 g/mol. Its IUPAC name is 4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-methylnaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-methylphenyl)naphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxynaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide.

Molecular Properties

Compound Name4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-methylnaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-methylphenyl)naphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxynaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide
PubChem CID160654883
Molecular FormulaC74H51N25O10
Molecular Weight1450.39 g/mol
Exact Mass1449.43
IUPAC Name4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-methylnaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-methylphenyl)naphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxynaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide
SMILESCNC(=O)c1cc2ccccc2c(/N=N/c2[nH]ncc2C#N)c1O.Cc1cccc(NC(=O)c2cc3ccccc3c(/N=N/c3[nH]ncc3C#N)c2O)c1.N#Cc1cn[nH]c1/N=N/c1c(O)c(C(=O)Nc2cccc([N+](=O)[O-])c2)cc2ccccc12.N#Cc1cn[nH]c1/N=N/c1c(O)c(C(N)=O)cc2ccccc12
InChIInChI=1S/C22H16N6O2.C21H13N7O4.C16H12N6O2.C15H10N6O2/c1-13-5-4-7-16(9-13)25-22(30)18-10-14-6-2-3-8-17(14)19(20(18)29)26-28-21-15(11-23)12-24-27-21;22-10-13-11-23-26-20(13)27-25-18-16-7-2-1-4-12(16)8-17(19(18)29)21(30)24-14-5-3-6-15(9-14)28(31)32;1-18-16(24)12-6-9-4-2-3-5-11(9)13(14(12)23)20-22-15-10(7-17)8-19-21-15;16-6-9-7-18-20-15(9)21-19-12-10-4-2-1-3-8(10)5-11(13(12)22)14(17)23/h2-10,12,29H,1H3,(H,24,27)(H,25,30);1-9,11,29H,(H,23,26)(H,24,30);2-6,8,23H,1H3,(H,18,24)(H,19,21);1-5,7,22H,(H2,17,23)(H,18,20)/b28-26+;27-25+;22-20+;21-19+
InChIKeyRKXJDIBXLCGWND-LJOCVEJBSA-N
XLogP15.40
TPSA563.21 Ų
H-Bond Donors12
H-Bond Acceptors26
Rotatable Bonds15
Heavy Atoms109
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001450.39
LogP ≤ 515.40
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-[(5-carbamoyl-2-methoxyphenyl)diazenyl]-3-hydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide
CID 136830288
3-hydroxy-4-[[2-methoxy-4-(methylcarbamoyl)phenyl]diazenyl]-N-(3-nitrophenyl)naphthalene-2-carboxamide
CID 137293433
4-[[5-(ethylcarbamoyl)-2-methoxyphenyl]diazenyl]-3-hydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide
CID 137304865
4-[[2-(dimethylcarbamoyl)-6-methoxyphenyl]diazenyl]-3-hydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide
CID 137293468
3-hydroxy-4-[[2-methoxy-5-(methylsulfamoyl)phenyl]diazenyl]-N-(3-nitrophenyl)naphthalene-2-carboxamide
CID 137304849
4-[[5-(dimethylsulfamoyl)-2-methoxyphenyl]diazenyl]-3-hydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide
CID 137304864
3-hydroxy-4-[[7-[[2-hydroxy-3-[(3-methylphenyl)carbamoyl]naphthalen-1-yl]diazenyl]-9-oxofluoren-2-yl]diazenyl]-N-phenylnaphthalene-2-carboxamide
CID 135731626
3-[[3-[[2-hydroxy-3-[(3-nitrophenyl)carbamoyl]naphthalen-1-yl]diazenyl]-4-methylphenyl]sulfonylamino]benzenesulfonic acid
CID 136863286
2-cyano-5-[[2-hydroxy-3-[[4-(hydroxymethyl)phenyl]carbamoyl]naphthalen-1-yl]diazenyl]-1H-pyrrole-3-carboxamide
CID 136598391
N-(4-chlorophenyl)-3-hydroxy-4-[(5-nitro-2,1-benzothiazol-3-yl)diazenyl]naphthalene-2-carboxamide
CID 136731060
N-(4-chloro-2-methylphenyl)-3-hydroxy-4-[(5-nitro-2,1-benzothiazol-3-yl)diazenyl]naphthalene-2-carboxamide
CID 136731061
3,5-dihydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide
CID 67849369

Frequently Asked Questions

What is the IUPAC name of 4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-methylnaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-methylphenyl)naphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxynaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide?
The IUPAC name of 4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-methylnaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-methylphenyl)naphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxynaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide (CID 160654883) is 4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-methylnaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-methylphenyl)naphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxynaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide.
What is the SMILES notation for 4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-methylnaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-methylphenyl)naphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxynaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide?
The canonical SMILES for 4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-methylnaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-methylphenyl)naphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxynaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide is CNC(=O)c1cc2ccccc2c(/N=N/c2[nH]ncc2C#N)c1O.Cc1cccc(NC(=O)c2cc3ccccc3c(/N=N/c3[nH]ncc3C#N)c2O)c1.N#Cc1cn[nH]c1/N=N/c1c(O)c(C(=O)Nc2cccc([N+](=O)[O-])c2)cc2ccccc12.N#Cc1cn[nH]c1/N=N/c1c(O)c(C(N)=O)cc2ccccc12.
What is the InChIKey of 4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-methylnaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-methylphenyl)naphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxynaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide?
The InChIKey is RKXJDIBXLCGWND-LJOCVEJBSA-N. The full InChI is InChI=1S/C22H16N6O2.C21H13N7O4.C16H12N6O2.C15H10N6O2/c1-13-5-4-7-16(9-13)25-22(30)18-10-14-6-2-3-8-17(14)19(20(18)29)26-28-21-15(11-23)12-24-27-21;22-10-13-11-23-26-20(13)27-25-18-16-7-2-1-4-12(16)8-17(19(18)29)21(30)24-14-5-3-6-15(9-14)28(31)32;1-18-16(24)12-6-9-4-2-3-5-11(9)13(14(12)23)20-22-15-10(7-17)8-19-21-15;16-6-9-7-18-20-15(9)21-19-12-10-4-2-1-3-8(10)5-11(13(12)22)14(17)23/h2-10,12,29H,1H3,(H,24,27)(H,25,30);1-9,11,29H,(H,23,26)(H,24,30);2-6,8,23H,1H3,(H,18,24)(H,19,21);1-5,7,22H,(H2,17,23)(H,18,20)/b28-26+;27-25+;22-20+;21-19+.
What are the key properties of 4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-methylnaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-methylphenyl)naphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxynaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide?
4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-methylnaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-methylphenyl)naphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxynaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide has a molecular weight of 1450.39 g/mol, XLogP of 15.40, 15 rotatable bonds, 12 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-methylnaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-methylphenyl)naphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxynaphthalene-2-carboxamide;4-[(4-cyano-1H-pyrazol-5-yl)diazenyl]-3-hydroxy-N-(3-nitrophenyl)naphthalene-2-carboxamide is sourced from PubChem (CID 160654883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).