[2-[dimethyl-[4-(N-phenylanilino)phenyl]silyl]phenyl]methanol

C27H27NOSi — CID 23642962

IUPAC[2-[dimethyl-[4-(N-phenylanilino)phenyl]silyl]phenyl]methanol
SMILESC[Si](C)(c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1CO
InChIInChI=1S/C27H27NOSi/c1-30(2,27-16-10-9-11-22(27)21-29)26-19-17-25(18-20-26)28(23-12-5-3-6-13-23)24-14-7-4-8-15-24/h3-20,29H,21H2,1-2H3
InChIKeyJIGJXZQBGQVASP-UHFFFAOYSA-N
MW409.61 g/mol
LogP5.47
Rot. Bonds6

About [2-[dimethyl-[4-(N-phenylanilino)phenyl]silyl]phenyl]methanol

[2-[dimethyl-[4-(N-phenylanilino)phenyl]silyl]phenyl]methanol (PubChem CID 23642962) has the molecular formula C27H27NOSi and a molecular weight of 409.61 g/mol. Its IUPAC name is [2-[dimethyl-[4-(N-phenylanilino)phenyl]silyl]phenyl]methanol.

Molecular Properties

Compound Name[2-[dimethyl-[4-(N-phenylanilino)phenyl]silyl]phenyl]methanol
PubChem CID23642962
Molecular FormulaC27H27NOSi
Molecular Weight409.61 g/mol
Exact Mass409.19
IUPAC Name[2-[dimethyl-[4-(N-phenylanilino)phenyl]silyl]phenyl]methanol
SMILESC[Si](C)(c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1CO
InChIInChI=1S/C27H27NOSi/c1-30(2,27-16-10-9-11-22(27)21-29)26-19-17-25(18-20-26)28(23-12-5-3-6-13-23)24-14-7-4-8-15-24/h3-20,29H,21H2,1-2H3
InChIKeyJIGJXZQBGQVASP-UHFFFAOYSA-N
XLogP5.47
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500409.61
LogP ≤ 55.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[2-[[4-[4-[[2-(hydroxymethyl)phenyl]-dimethylsilyl]phenyl]phenyl]-dimethylsilyl]phenyl]methanol
CID 75412539
[2-[dimethyl-(3-methylphenyl)silyl]phenyl]methanol
CID 177402888
N-[4-[dimethyl-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]silyl]phenyl]-4-methyl-N-(4-methylphenyl)aniline
CID 71342733
4-[dichloro(ethyl)silyl]-N,N-diphenylaniline
CID 23434748
ethane;1-N,1-N,4-N,4-N-tetraphenylbenzene-1,4-diamine
CID 91310242
N,N-diphenyl-4-[4-[4-(N-(4-trimethylsilylphenyl)anilino)phenyl]phenyl]aniline;N,4-diphenyl-N-[4-[4-[4-(N-(4-trimethylsilylphenyl)anilino)phenyl]phenyl]phenyl]aniline;4-phenyl-N-[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]-N-(4-trimethylsilylphenyl)aniline
CID 165073252
[4-(hydroxymethyl)-3-[4-(N-phenylanilino)phenyl]phenyl]methanol
CID 18504276
N,N-diphenylaniline;phenylmethanol
CID 174958363
N,N-diphenyl-4-[12-[4-(N-phenylanilino)phenyl]-3,9-bis(trimethylsilyl)chrysen-6-yl]aniline
CID 58879315
N-[4-[[4-(dipyridin-2-ylamino)phenyl]-dimethylsilyl]phenyl]-N-pyridin-2-ylpyridin-2-amine
CID 101222424
N-phenyl-N-(4-trimethylsilylphenyl)-4-[6-[4-(N-(4-trimethylsilylphenyl)anilino)phenyl]benzo[e]pyren-3-yl]aniline
CID 123737685
N-[4-[dimethoxy(methyl)silyl]phenyl]-4-[4-(N-[4-[dimethoxy(methyl)silyl]phenyl]anilino)phenyl]-N-phenylaniline
CID 58879109

Frequently Asked Questions

What is the IUPAC name of [2-[dimethyl-[4-(N-phenylanilino)phenyl]silyl]phenyl]methanol?
The IUPAC name of [2-[dimethyl-[4-(N-phenylanilino)phenyl]silyl]phenyl]methanol (CID 23642962) is [2-[dimethyl-[4-(N-phenylanilino)phenyl]silyl]phenyl]methanol.
What is the SMILES notation for [2-[dimethyl-[4-(N-phenylanilino)phenyl]silyl]phenyl]methanol?
The canonical SMILES for [2-[dimethyl-[4-(N-phenylanilino)phenyl]silyl]phenyl]methanol is C[Si](C)(c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1CO.
What is the InChIKey of [2-[dimethyl-[4-(N-phenylanilino)phenyl]silyl]phenyl]methanol?
The InChIKey is JIGJXZQBGQVASP-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H27NOSi/c1-30(2,27-16-10-9-11-22(27)21-29)26-19-17-25(18-20-26)28(23-12-5-3-6-13-23)24-14-7-4-8-15-24/h3-20,29H,21H2,1-2H3.
What are the key properties of [2-[dimethyl-[4-(N-phenylanilino)phenyl]silyl]phenyl]methanol?
[2-[dimethyl-[4-(N-phenylanilino)phenyl]silyl]phenyl]methanol has a molecular weight of 409.61 g/mol, XLogP of 5.47, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[dimethyl-[4-(N-phenylanilino)phenyl]silyl]phenyl]methanol is sourced from PubChem (CID 23642962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).