CID 155632800

C25H54N3Si — CID 155632800

IUPAC—
SMILESCCCCCCCCCCCCCCCCCC/N=C(\N(C)C)N(C)C[Si](C)C
InChIInChI=1S/C25H54N3Si/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-25(27(2)3)28(4)24-29(5)6/h7-24H2,1-6H3/b26-25+
InChIKeyBQNJJCRHQBASEB-OCEACIFDSA-N
MW424.81 g/mol
LogP7.39
Rot. Bonds19

About CID 155632800

CID 155632800 (PubChem CID 155632800) has the molecular formula C25H54N3Si and a molecular weight of 424.81 g/mol.

Molecular Properties

Compound NameCID 155632800
PubChem CID155632800
Molecular FormulaC25H54N3Si
Molecular Weight424.81 g/mol
Exact Mass424.41
IUPAC Name—
SMILESCCCCCCCCCCCCCCCCCC/N=C(\N(C)C)N(C)C[Si](C)C
InChIInChI=1S/C25H54N3Si/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-25(27(2)3)28(4)24-29(5)6/h7-24H2,1-6H3/b26-25+
InChIKeyBQNJJCRHQBASEB-OCEACIFDSA-N
XLogP7.39
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds19
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.81
LogP ≤ 57.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

1,1,3,3-tetramethyl-2-octadecylguanidine
CID 153446328
2-decyl-1,1,3,3-tetramethylguanidine
CID 13127985
1-(dimethylsilylmethyl)-2-heptyl-1,3,3-trimethylguanidine
CID 159110043
carbonic acid;N,N-dimethyl-N'-octylethanimidamide
CID 173151477
carbonic acid;N'-hexyl-N,N-dimethylethanimidamide
CID 173151515
N,N,2-trimethyl-N'-pentylpropanimidamide
CID 525910
methyl N-decylethanimidate
CID 51355250
2-hydroxyimino-N,N-dimethyl-N'-pentylethanimidamide
CID 136598188
1,1,3,3-tetramethyl-2-(5-methylhexyl)guanidine
CID 111813185
N'-decyl-N,N-dimethylbenzenecarboximidamide
CID 525622
2-[(N'-dodecylcarbamimidoyl)-methylamino]acetic acid
CID 87453757
2-[3-(diethylamino)propyl]-1,1,3,3-tetramethylguanidine;hydroiodide
CID 111025375

Frequently Asked Questions

What is the IUPAC name of CID 155632800?
The IUPAC name of CID 155632800 (CID 155632800) is not available.
What is the SMILES notation for CID 155632800?
The canonical SMILES for CID 155632800 is CCCCCCCCCCCCCCCCCC/N=C(\N(C)C)N(C)C[Si](C)C.
What is the InChIKey of CID 155632800?
The InChIKey is BQNJJCRHQBASEB-OCEACIFDSA-N. The full InChI is InChI=1S/C25H54N3Si/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-25(27(2)3)28(4)24-29(5)6/h7-24H2,1-6H3/b26-25+.
What are the key properties of CID 155632800?
CID 155632800 has a molecular weight of 424.81 g/mol, XLogP of 7.39, 19 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 155632800 is sourced from PubChem (CID 155632800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).