CID 70058698

C15H23NSi — CID 70058698

IUPAC—
SMILESCc1ccc(C[Si]CN2CCCCC2)c(C)c1
InChIInChI=1S/C15H23NSi/c1-13-6-7-15(14(2)10-13)11-17-12-16-8-4-3-5-9-16/h6-7,10H,3-5,8-9,11-12H2,1-2H3
InChIKeyLZDBHZBESUVKKI-UHFFFAOYSA-N
MW245.44 g/mol
LogP2.95
Rot. Bonds4

About CID 70058698

CID 70058698 (PubChem CID 70058698) has the molecular formula C15H23NSi and a molecular weight of 245.44 g/mol.

Molecular Properties

Compound NameCID 70058698
PubChem CID70058698
Molecular FormulaC15H23NSi
Molecular Weight245.44 g/mol
Exact Mass245.16
IUPAC Name—
SMILESCc1ccc(C[Si]CN2CCCCC2)c(C)c1
InChIInChI=1S/C15H23NSi/c1-13-6-7-15(14(2)10-13)11-17-12-16-8-4-3-5-9-16/h6-7,10H,3-5,8-9,11-12H2,1-2H3
InChIKeyLZDBHZBESUVKKI-UHFFFAOYSA-N
XLogP2.95
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.44
LogP ≤ 52.95
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

2-(2,4-dimethylphenyl)-1-pyrrolidin-1-ylethanone
CID 95970810
2-(azocan-1-yl)-1-(2,4-dimethylphenyl)ethanone
CID 43219875
1-[2-(2,4-dimethylphenyl)ethyl]piperidine-2,6-dione
CID 82130524
N-[(2,4-dimethylphenyl)methyl]-6-piperidin-1-ylpyrimidin-4-amine
CID 133297567
2-(azepan-1-yl)-N-[4-[(2,4-dimethylphenyl)methylamino]phenyl]acetamide
CID 112839494
5-methyl-2-(pyrrolidin-1-ylmethyl)benzoic acid
CID 117220857
1-(2,4-dimethylphenyl)-2-pyrrolidin-1-ylethanamine
CID 16643538
N-[2-(azepan-1-yl)ethyl]-1-(2,5-dimethylphenyl)ethanamine
CID 61240183
1-[(2,4-dimethylphenyl)methyl]azepane-2-carboxylic acid
CID 65069954
3-methyl-4-(piperidin-1-ylmethyl)benzonitrile
CID 114480957
3-[1-[(2,4-dimethylphenyl)methyl]piperidin-3-yl]propanoic acid
CID 65072325
1-ethyl-2,4-dimethylbenzene;propane
CID 143347602

Frequently Asked Questions

What is the IUPAC name of CID 70058698?
The IUPAC name of CID 70058698 (CID 70058698) is not available.
What is the SMILES notation for CID 70058698?
The canonical SMILES for CID 70058698 is Cc1ccc(C[Si]CN2CCCCC2)c(C)c1.
What is the InChIKey of CID 70058698?
The InChIKey is LZDBHZBESUVKKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NSi/c1-13-6-7-15(14(2)10-13)11-17-12-16-8-4-3-5-9-16/h6-7,10H,3-5,8-9,11-12H2,1-2H3.
What are the key properties of CID 70058698?
CID 70058698 has a molecular weight of 245.44 g/mol, XLogP of 2.95, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 70058698 is sourced from PubChem (CID 70058698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).