[4-[N-(3,4-dimethylphenyl)-4-(hydroxymethyl)anilino]phenyl]methanol;[4-[4-[4-[4-(hydroxymethyl)-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]methanol;[4-[4-(hydroxymethyl)-N-(4-phenylphenyl)anilino]phenyl]methanol;3-(N-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]anilino)phenol;3-(N-[4-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenol

C168H146N8O12 — CID 162220558

IUPAC[4-[N-(3,4-dimethylphenyl)-4-(hydroxymethyl)anilino]phenyl]methanol;[4-[4-[4-[4-(hydroxymethyl)-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]methanol;[4-[4-(hydroxymethyl)-N-(4-phenylphenyl)anilino]phenyl]methanol;3-(N-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]anilino)phenol;3-(N-[4-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenol
SMILESCc1cc(N(c2ccc(CO)cc2)c2ccc(-c3ccc(N(c4ccc(CO)cc4)c4ccc(CO)c(C)c4)cc3)cc2)ccc1CO.Cc1ccc(N(c2ccc(CO)cc2)c2ccc(CO)cc2)cc1C.OCc1ccc(N(c2ccc(CO)cc2)c2ccc(-c3ccccc3)cc2)cc1.Oc1cccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5cccc(O)c5)cc4)cc3)cc2)c1.Oc1cccc(N(c2ccccc2)c2ccc(-c3ccc(N(c4ccccc4)c4cccc(O)c4)cc3)cc2)c1
InChIInChI=1S/C42H40N2O4.C42H32N2O2.C36H28N2O2.C26H23NO2.C22H23NO2/c1-29-23-41(21-11-35(29)27-47)43(37-13-3-31(25-45)4-14-37)39-17-7-33(8-18-39)34-9-19-40(20-10-34)44(38-15-5-32(26-46)6-16-38)42-22-12-36(28-48)30(2)24-42;45-41-15-7-13-39(29-41)43(35-9-3-1-4-10-35)37-25-21-33(22-26-37)31-17-19-32(20-18-31)34-23-27-38(28-24-34)44(36-11-5-2-6-12-36)40-14-8-16-42(46)30-40;39-35-15-7-13-33(25-35)37(29-9-3-1-4-10-29)31-21-17-27(18-22-31)28-19-23-32(24-20-28)38(30-11-5-2-6-12-30)34-14-8-16-36(40)26-34;28-18-20-6-12-24(13-7-20)27(25-14-8-21(19-29)9-15-25)26-16-10-23(11-17-26)22-4-2-1-3-5-22;1-16-3-8-22(13-17(16)2)23(20-9-4-18(14-24)5-10-20)21-11-6-19(15-25)7-12-21/h3-24,45-48H,25-28H2,1-2H3;1-30,45-46H;1-26,39-40H;1-17,28-29H,18-19H2;3-13,24-25H,14-15H2,1-2H3
InChIKeyZUBGLAFCCUAFNO-UHFFFAOYSA-N
MW2469.06 g/mol
LogP40.52
Rot. Bonds37

About [4-[N-(3,4-dimethylphenyl)-4-(hydroxymethyl)anilino]phenyl]methanol;[4-[4-[4-[4-(hydroxymethyl)-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]methanol;[4-[4-(hydroxymethyl)-N-(4-phenylphenyl)anilino]phenyl]methanol;3-(N-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]anilino)phenol;3-(N-[4-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenol

[4-[N-(3,4-dimethylphenyl)-4-(hydroxymethyl)anilino]phenyl]methanol;[4-[4-[4-[4-(hydroxymethyl)-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]methanol;[4-[4-(hydroxymethyl)-N-(4-phenylphenyl)anilino]phenyl]methanol;3-(N-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]anilino)phenol;3-(N-[4-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenol (PubChem CID 162220558) has the molecular formula C168H146N8O12 and a molecular weight of 2469.06 g/mol. Its IUPAC name is [4-[N-(3,4-dimethylphenyl)-4-(hydroxymethyl)anilino]phenyl]methanol;[4-[4-[4-[4-(hydroxymethyl)-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]methanol;[4-[4-(hydroxymethyl)-N-(4-phenylphenyl)anilino]phenyl]methanol;3-(N-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]anilino)phenol;3-(N-[4-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenol.

Molecular Properties

Compound Name[4-[N-(3,4-dimethylphenyl)-4-(hydroxymethyl)anilino]phenyl]methanol;[4-[4-[4-[4-(hydroxymethyl)-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]methanol;[4-[4-(hydroxymethyl)-N-(4-phenylphenyl)anilino]phenyl]methanol;3-(N-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]anilino)phenol;3-(N-[4-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenol
PubChem CID162220558
Molecular FormulaC168H146N8O12
Molecular Weight2469.06 g/mol
Exact Mass2467.11
IUPAC Name[4-[N-(3,4-dimethylphenyl)-4-(hydroxymethyl)anilino]phenyl]methanol;[4-[4-[4-[4-(hydroxymethyl)-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]methanol;[4-[4-(hydroxymethyl)-N-(4-phenylphenyl)anilino]phenyl]methanol;3-(N-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]anilino)phenol;3-(N-[4-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenol
SMILESCc1cc(N(c2ccc(CO)cc2)c2ccc(-c3ccc(N(c4ccc(CO)cc4)c4ccc(CO)c(C)c4)cc3)cc2)ccc1CO.Cc1ccc(N(c2ccc(CO)cc2)c2ccc(CO)cc2)cc1C.OCc1ccc(N(c2ccc(CO)cc2)c2ccc(-c3ccccc3)cc2)cc1.Oc1cccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5cccc(O)c5)cc4)cc3)cc2)c1.Oc1cccc(N(c2ccccc2)c2ccc(-c3ccc(N(c4ccccc4)c4cccc(O)c4)cc3)cc2)c1
InChIInChI=1S/C42H40N2O4.C42H32N2O2.C36H28N2O2.C26H23NO2.C22H23NO2/c1-29-23-41(21-11-35(29)27-47)43(37-13-3-31(25-45)4-14-37)39-17-7-33(8-18-39)34-9-19-40(20-10-34)44(38-15-5-32(26-46)6-16-38)42-22-12-36(28-48)30(2)24-42;45-41-15-7-13-39(29-41)43(35-9-3-1-4-10-35)37-25-21-33(22-26-37)31-17-19-32(20-18-31)34-23-27-38(28-24-34)44(36-11-5-2-6-12-36)40-14-8-16-42(46)30-40;39-35-15-7-13-33(25-35)37(29-9-3-1-4-10-29)31-21-17-27(18-22-31)28-19-23-32(24-20-28)38(30-11-5-2-6-12-30)34-14-8-16-36(40)26-34;28-18-20-6-12-24(13-7-20)27(25-14-8-21(19-29)9-15-25)26-16-10-23(11-17-26)22-4-2-1-3-5-22;1-16-3-8-22(13-17(16)2)23(20-9-4-18(14-24)5-10-20)21-11-6-19(15-25)7-12-21/h3-24,45-48H,25-28H2,1-2H3;1-30,45-46H;1-26,39-40H;1-17,28-29H,18-19H2;3-13,24-25H,14-15H2,1-2H3
InChIKeyZUBGLAFCCUAFNO-UHFFFAOYSA-N
XLogP40.52
TPSA268.68 Ų
H-Bond Donors12
H-Bond Acceptors20
Rotatable Bonds37
Heavy Atoms188
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002469.06
LogP ≤ 540.52
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1020

Analyze [4-[N-(3,4-dimethylphenyl)-4-(hydroxymethyl)anilino]phenyl]methanol;[4-[4-[4-[4-(hydroxymethyl)-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]methanol;[4-[4-(hydroxymethyl)-N-(4-phenylphenyl)anilino]phenyl]methanol;3-(N-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]anilino)phenol;3-(N-[4-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenol with MolForge

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Related Compounds

[4-[N-[4-(hydroxymethyl)-3-methylphenyl]-4-[4-(N-[4-(hydroxymethyl)-3-methylphenyl]-4-methylanilino)phenyl]anilino]phenyl]methanol
CID 59392122
[4-(N-(3,4-dimethylphenyl)-3,4-dimethylanilino)phenyl]methanol
CID 54528653
1-N,4-N-bis(3,4-dimethylphenyl)-1-N,4-N-bis(4-phenylphenyl)benzene-1,4-diamine
CID 59470459
N-[4-[4-[4-(N-(3,4-dimethylphenyl)anilino)phenyl]phenyl]phenyl]-3,4-dimethyl-N-phenylaniline
CID 137434908
ethane;3-(N-(4-methylphenyl)anilino)phenol
CID 144899078
[4-(hydroxymethyl)-3-[4-(N-phenylanilino)phenyl]phenyl]methanol
CID 18504276
[4-(N-(2,4-dimethylphenyl)anilino)-2-methylphenyl]methanol
CID 20580195
[5-(N-[4-[4-[4-(N-(3-methoxy-4-methylphenyl)anilino)phenyl]phenyl]phenyl]anilino)-2-methylphenyl]methanol
CID 59148672
2-(2-hydroxyethoxy)ethanol;3-(N-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]anilino)phenol
CID 67803503
[4-(N-(4-ethylphenyl)-4-methylanilino)phenyl]methanol;[4-(N-[4-(hydroxymethyl)phenyl]anilino)phenyl]methanol
CID 159917038
2-[4-(N-(3,4-dimethylphenyl)-4-phenylanilino)phenyl]ethyl prop-2-enoate
CID 170007474
3-(N-[3-[3-(N-(3-hydroxyphenyl)anilino)phenyl]-4-phenylphenyl]anilino)phenol
CID 66649452

Frequently Asked Questions

What is the IUPAC name of [4-[N-(3,4-dimethylphenyl)-4-(hydroxymethyl)anilino]phenyl]methanol;[4-[4-[4-[4-(hydroxymethyl)-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]methanol;[4-[4-(hydroxymethyl)-N-(4-phenylphenyl)anilino]phenyl]methanol;3-(N-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]anilino)phenol;3-(N-[4-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenol?
The IUPAC name of [4-[N-(3,4-dimethylphenyl)-4-(hydroxymethyl)anilino]phenyl]methanol;[4-[4-[4-[4-(hydroxymethyl)-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]methanol;[4-[4-(hydroxymethyl)-N-(4-phenylphenyl)anilino]phenyl]methanol;3-(N-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]anilino)phenol;3-(N-[4-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenol (CID 162220558) is [4-[N-(3,4-dimethylphenyl)-4-(hydroxymethyl)anilino]phenyl]methanol;[4-[4-[4-[4-(hydroxymethyl)-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]methanol;[4-[4-(hydroxymethyl)-N-(4-phenylphenyl)anilino]phenyl]methanol;3-(N-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]anilino)phenol;3-(N-[4-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenol.
What is the SMILES notation for [4-[N-(3,4-dimethylphenyl)-4-(hydroxymethyl)anilino]phenyl]methanol;[4-[4-[4-[4-(hydroxymethyl)-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]methanol;[4-[4-(hydroxymethyl)-N-(4-phenylphenyl)anilino]phenyl]methanol;3-(N-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]anilino)phenol;3-(N-[4-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenol?
The canonical SMILES for [4-[N-(3,4-dimethylphenyl)-4-(hydroxymethyl)anilino]phenyl]methanol;[4-[4-[4-[4-(hydroxymethyl)-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]methanol;[4-[4-(hydroxymethyl)-N-(4-phenylphenyl)anilino]phenyl]methanol;3-(N-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]anilino)phenol;3-(N-[4-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenol is Cc1cc(N(c2ccc(CO)cc2)c2ccc(-c3ccc(N(c4ccc(CO)cc4)c4ccc(CO)c(C)c4)cc3)cc2)ccc1CO.Cc1ccc(N(c2ccc(CO)cc2)c2ccc(CO)cc2)cc1C.OCc1ccc(N(c2ccc(CO)cc2)c2ccc(-c3ccccc3)cc2)cc1.Oc1cccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5cccc(O)c5)cc4)cc3)cc2)c1.Oc1cccc(N(c2ccccc2)c2ccc(-c3ccc(N(c4ccccc4)c4cccc(O)c4)cc3)cc2)c1.
What is the InChIKey of [4-[N-(3,4-dimethylphenyl)-4-(hydroxymethyl)anilino]phenyl]methanol;[4-[4-[4-[4-(hydroxymethyl)-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]methanol;[4-[4-(hydroxymethyl)-N-(4-phenylphenyl)anilino]phenyl]methanol;3-(N-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]anilino)phenol;3-(N-[4-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenol?
The InChIKey is ZUBGLAFCCUAFNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H40N2O4.C42H32N2O2.C36H28N2O2.C26H23NO2.C22H23NO2/c1-29-23-41(21-11-35(29)27-47)43(37-13-3-31(25-45)4-14-37)39-17-7-33(8-18-39)34-9-19-40(20-10-34)44(38-15-5-32(26-46)6-16-38)42-22-12-36(28-48)30(2)24-42;45-41-15-7-13-39(29-41)43(35-9-3-1-4-10-35)37-25-21-33(22-26-37)31-17-19-32(20-18-31)34-23-27-38(28-24-34)44(36-11-5-2-6-12-36)40-14-8-16-42(46)30-40;39-35-15-7-13-33(25-35)37(29-9-3-1-4-10-29)31-21-17-27(18-22-31)28-19-23-32(24-20-28)38(30-11-5-2-6-12-30)34-14-8-16-36(40)26-34;28-18-20-6-12-24(13-7-20)27(25-14-8-21(19-29)9-15-25)26-16-10-23(11-17-26)22-4-2-1-3-5-22;1-16-3-8-22(13-17(16)2)23(20-9-4-18(14-24)5-10-20)21-11-6-19(15-25)7-12-21/h3-24,45-48H,25-28H2,1-2H3;1-30,45-46H;1-26,39-40H;1-17,28-29H,18-19H2;3-13,24-25H,14-15H2,1-2H3.
What are the key properties of [4-[N-(3,4-dimethylphenyl)-4-(hydroxymethyl)anilino]phenyl]methanol;[4-[4-[4-[4-(hydroxymethyl)-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]methanol;[4-[4-(hydroxymethyl)-N-(4-phenylphenyl)anilino]phenyl]methanol;3-(N-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]anilino)phenol;3-(N-[4-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenol?
[4-[N-(3,4-dimethylphenyl)-4-(hydroxymethyl)anilino]phenyl]methanol;[4-[4-[4-[4-(hydroxymethyl)-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]methanol;[4-[4-(hydroxymethyl)-N-(4-phenylphenyl)anilino]phenyl]methanol;3-(N-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]anilino)phenol;3-(N-[4-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenol has a molecular weight of 2469.06 g/mol, XLogP of 40.52, 37 rotatable bonds, 12 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[N-(3,4-dimethylphenyl)-4-(hydroxymethyl)anilino]phenyl]methanol;[4-[4-[4-[4-(hydroxymethyl)-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]-N-[4-(hydroxymethyl)-3-methylphenyl]anilino]phenyl]methanol;[4-[4-(hydroxymethyl)-N-(4-phenylphenyl)anilino]phenyl]methanol;3-(N-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]anilino)phenol;3-(N-[4-[4-[4-(N-(3-hydroxyphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenol is sourced from PubChem (CID 162220558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).