CID 87456465

C9H22NO2Si — CID 87456465

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

About CID 87456465

CID 87456465 (PubChem CID 87456465) has the molecular formula C9H22NO2Si and a molecular weight of 204.37 g/mol.

Molecular Properties

Compound NameCID 87456465
PubChem CID87456465
Molecular FormulaC9H22NO2Si
Molecular Weight204.37 g/mol
Exact Mass204.14
IUPAC Name—
SMILESCO[Si](OC)C(C)CCCCCN
InChIInChI=1S/C9H22NO2Si/c1-9(13(11-2)12-3)7-5-4-6-8-10/h9H,4-8,10H2,1-3H3
InChIKeySRYSFNHSBUVZDE-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': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

36-methylheptatriacontan-1-amine
CID 134324173
6-(3-aminopropoxy)heptan-1-amine
CID 142972624
18-methylnonadecan-1-amine;hydrochloride
CID 173047380
(8S)-nonane-1,8-diamine
CID 87205838
decane-1,9-diamine
CID 23448369
undecane-1,10-diamine
CID 140782210
12-ethyltetradecan-1-amine
CID 87456130
3,4-dimethyldecane-1,10-diamine
CID 118234620
6-fluoroheptan-1-amine
CID 83855129
7,7-di(propan-2-yloxy)heptan-1-amine
CID 19069536
5,9-dimethyloctadecan-1-amine
CID 174923758
2-methyldecane-1,1,10-triamine
CID 175230718

Frequently Asked Questions

What is the IUPAC name of CID 87456465?
The IUPAC name of CID 87456465 (CID 87456465) is not available.
What is the SMILES notation for CID 87456465?
The canonical SMILES for CID 87456465 is CO[Si](OC)C(C)CCCCCN.
What is the InChIKey of CID 87456465?
The InChIKey is SRYSFNHSBUVZDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22NO2Si/c1-9(13(11-2)12-3)7-5-4-6-8-10/h9H,4-8,10H2,1-3H3.
What are the key properties of CID 87456465?
CID 87456465 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 87456465 is sourced from PubChem (CID 87456465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).