CID 87772265

C9H22NO2Si — CID 87772265

IUPAC—
SMILESCCO[Si](OCC)C(CC)CCN
InChIInChI=1S/C9H22NO2Si/c1-4-9(7-8-10)13(11-5-2)12-6-3/h9H,4-8,10H2,1-3H3
InChIKeyGORSUJMFPBBXNV-UHFFFAOYSA-N
MW204.37 g/mol
LogP1.68
Rot. Bonds8

About CID 87772265

CID 87772265 (PubChem CID 87772265) has the molecular formula C9H22NO2Si and a molecular weight of 204.37 g/mol.

Molecular Properties

Compound NameCID 87772265
PubChem CID87772265
Molecular FormulaC9H22NO2Si
Molecular Weight204.37 g/mol
Exact Mass204.14
IUPAC Name—
SMILESCCO[Si](OCC)C(CC)CCN
InChIInChI=1S/C9H22NO2Si/c1-4-9(7-8-10)13(11-5-2)12-6-3/h9H,4-8,10H2,1-3H3
InChIKeyGORSUJMFPBBXNV-UHFFFAOYSA-N
XLogP1.68
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.37
LogP ≤ 51.68
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

3-ethyl-4-methylhexan-1-amine
CID 123538643
azane;butane-1,3-diamine;pentane-1,3-diamine
CID 174966617
3-(difluoromethoxy)pentan-1-amine
CID 84716511
3-cyclopropylpentan-1-amine
CID 64919361
5-[ethoxy(methyl)silyl]pentane-1,3-diamine
CID 150032402
3-(4-ethoxypiperidin-1-yl)pentan-1-amine
CID 61218236
CID 22242137
CID 22242137
5-ethoxy-3-methylpentan-1-amine
CID 87063287
4-ethoxyhexan-1-amine
CID 21432824
3-[(2-methylpropan-2-yl)oxy]pentan-1-amine
CID 43368459
5-dimethoxysilylpentane-1,3-diamine
CID 123921736
(3S)-3-cyclopentyl-3-ethoxypropan-1-amine
CID 95757314

Frequently Asked Questions

What is the IUPAC name of CID 87772265?
The IUPAC name of CID 87772265 (CID 87772265) is not available.
What is the SMILES notation for CID 87772265?
The canonical SMILES for CID 87772265 is CCO[Si](OCC)C(CC)CCN.
What is the InChIKey of CID 87772265?
The InChIKey is GORSUJMFPBBXNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22NO2Si/c1-4-9(7-8-10)13(11-5-2)12-6-3/h9H,4-8,10H2,1-3H3.
What are the key properties of CID 87772265?
CID 87772265 has a molecular weight of 204.37 g/mol, XLogP of 1.68, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87772265 is sourced from PubChem (CID 87772265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).