CID 22363084

C12H26NO2Si — CID 22363084

IUPAC—
SMILESCCO[Si](CC(N)C1CCCCC1)OCC
InChIInChI=1S/C12H26NO2Si/c1-3-14-16(15-4-2)10-12(13)11-8-6-5-7-9-11/h11-12H,3-10,13H2,1-2H3
InChIKeySCFKUOURVDPZRF-UHFFFAOYSA-N
MW244.43 g/mol
LogP2.46
Rot. Bonds7

About CID 22363084

CID 22363084 (PubChem CID 22363084) has the molecular formula C12H26NO2Si and a molecular weight of 244.43 g/mol.

Molecular Properties

Compound NameCID 22363084
PubChem CID22363084
Molecular FormulaC12H26NO2Si
Molecular Weight244.43 g/mol
Exact Mass244.17
IUPAC Name—
SMILESCCO[Si](CC(N)C1CCCCC1)OCC
InChIInChI=1S/C12H26NO2Si/c1-3-14-16(15-4-2)10-12(13)11-8-6-5-7-9-11/h11-12H,3-10,13H2,1-2H3
InChIKeySCFKUOURVDPZRF-UHFFFAOYSA-N
XLogP2.46
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.43
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(1S)-1-cyclopentylethane-1,2-diamine
CID 55292792
1-cyclohexyl-3-ethylpentan-1-amine
CID 82920637
(1S)-1,2-dicyclohexylethanamine
CID 44574818
2-cycloheptyl-1-cyclopentylethanamine
CID 115779065
1-cycloheptylheptan-1-amine
CID 65399314
1-cyclohexyl-3-propan-2-yloxypropan-1-amine
CID 114998646
1-cycloheptyl-2-ethoxy-2-methylpropan-1-amine
CID 116726355
(1S)-1-cyclohexyl-3,3-dimethylbutan-1-amine
CID 130039908
(1R)-1-cyclopentylpentan-1-amine
CID 55292231
1-cyclohexyl-4-methoxypentan-1-amine
CID 105079909
1-cyclohexyl-2-propylsulfanylethanamine
CID 65128728
1-cyclopentyl-2-methylsulfanylethanamine
CID 62691520

Frequently Asked Questions

What is the IUPAC name of CID 22363084?
The IUPAC name of CID 22363084 (CID 22363084) is not available.
What is the SMILES notation for CID 22363084?
The canonical SMILES for CID 22363084 is CCO[Si](CC(N)C1CCCCC1)OCC.
What is the InChIKey of CID 22363084?
The InChIKey is SCFKUOURVDPZRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26NO2Si/c1-3-14-16(15-4-2)10-12(13)11-8-6-5-7-9-11/h11-12H,3-10,13H2,1-2H3.
What are the key properties of CID 22363084?
CID 22363084 has a molecular weight of 244.43 g/mol, XLogP of 2.46, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 22363084 is sourced from PubChem (CID 22363084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).