4-methylsilyl-N-phenyl-N-propan-2-ylaniline

C16H21NSi — CID 159314812

IUPAC4-methylsilyl-N-phenyl-N-propan-2-ylaniline
SMILESC[SiH2]c1ccc(N(c2ccccc2)C(C)C)cc1
InChIInChI=1S/C16H21NSi/c1-13(2)17(14-7-5-4-6-8-14)15-9-11-16(18-3)12-10-15/h4-13H,18H2,1-3H3
InChIKeyIZPAFBBDUAAYGI-UHFFFAOYSA-N
MW255.44 g/mol
LogP3.08
Rot. Bonds4

About 4-methylsilyl-N-phenyl-N-propan-2-ylaniline

4-methylsilyl-N-phenyl-N-propan-2-ylaniline (PubChem CID 159314812) has the molecular formula C16H21NSi and a molecular weight of 255.44 g/mol. Its IUPAC name is 4-methylsilyl-N-phenyl-N-propan-2-ylaniline.

Molecular Properties

Compound Name4-methylsilyl-N-phenyl-N-propan-2-ylaniline
PubChem CID159314812
Molecular FormulaC16H21NSi
Molecular Weight255.44 g/mol
Exact Mass255.14
IUPAC Name4-methylsilyl-N-phenyl-N-propan-2-ylaniline
SMILESC[SiH2]c1ccc(N(c2ccccc2)C(C)C)cc1
InChIInChI=1S/C16H21NSi/c1-13(2)17(14-7-5-4-6-8-14)15-9-11-16(18-3)12-10-15/h4-13H,18H2,1-3H3
InChIKeyIZPAFBBDUAAYGI-UHFFFAOYSA-N
XLogP3.08
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.44
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4-fluoro-N-phenyl-N-propan-2-ylaniline
CID 10998781
(2R,3R)-2-N,2-N,3-N,3-N-tetraphenylbutane-2,3-diamine
CID 139888641
CID 159262855
CID 159262855
azane;methyl(phenyl)silane
CID 175135005
N-methylsilyl-N-propan-2-ylaniline
CID 123495620
4-phenyl-N-propan-2-yl-N-(4-trimethylsilylphenyl)aniline
CID 59308390
1-(4-chlorophenyl)-3-[4-(N-propan-2-ylanilino)phenyl]urea
CID 2359267
2-ethenyl-N-phenyl-N-propan-2-ylaniline
CID 134354735
(2S)-2-(N-(4-bromophenyl)anilino)propanoic acid
CID 142700956
4-N-phenyl-4-N-(1-phenylethyl)benzene-1,4-diamine
CID 67775594
N-benzhydryl-N-propan-2-ylaniline
CID 174429757
N-phenyl-N-propan-2-ylquinolin-2-amine
CID 59282154

Frequently Asked Questions

What is the IUPAC name of 4-methylsilyl-N-phenyl-N-propan-2-ylaniline?
The IUPAC name of 4-methylsilyl-N-phenyl-N-propan-2-ylaniline (CID 159314812) is 4-methylsilyl-N-phenyl-N-propan-2-ylaniline.
What is the SMILES notation for 4-methylsilyl-N-phenyl-N-propan-2-ylaniline?
The canonical SMILES for 4-methylsilyl-N-phenyl-N-propan-2-ylaniline is C[SiH2]c1ccc(N(c2ccccc2)C(C)C)cc1.
What is the InChIKey of 4-methylsilyl-N-phenyl-N-propan-2-ylaniline?
The InChIKey is IZPAFBBDUAAYGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NSi/c1-13(2)17(14-7-5-4-6-8-14)15-9-11-16(18-3)12-10-15/h4-13H,18H2,1-3H3.
What are the key properties of 4-methylsilyl-N-phenyl-N-propan-2-ylaniline?
4-methylsilyl-N-phenyl-N-propan-2-ylaniline has a molecular weight of 255.44 g/mol, XLogP of 3.08, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylsilyl-N-phenyl-N-propan-2-ylaniline is sourced from PubChem (CID 159314812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).