5-ethyl-5-(nitrosomethyl)nonane

C12H25NO — CID 118288001

IUPAC5-ethyl-5-(nitrosomethyl)nonane
SMILESCCCCC(CC)(CCCC)CN=O
InChIInChI=1S/C12H25NO/c1-4-7-9-12(6-3,11-13-14)10-8-5-2/h4-11H2,1-3H3
InChIKeyWREJYZFVUYKRIV-UHFFFAOYSA-N
MW199.34 g/mol
LogP4.53
Rot. Bonds9

About 5-ethyl-5-(nitrosomethyl)nonane

5-ethyl-5-(nitrosomethyl)nonane (PubChem CID 118288001) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 5-ethyl-5-(nitrosomethyl)nonane.

Molecular Properties

Compound Name5-ethyl-5-(nitrosomethyl)nonane
PubChem CID118288001
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name5-ethyl-5-(nitrosomethyl)nonane
SMILESCCCCC(CC)(CCCC)CN=O
InChIInChI=1S/C12H25NO/c1-4-7-9-12(6-3,11-13-14)10-8-5-2/h4-11H2,1-3H3
InChIKeyWREJYZFVUYKRIV-UHFFFAOYSA-N
XLogP4.53
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 140960006
2-ethyl-2-(nitrosomethyl)butan-1-ol
CID 89240563
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CID 177031380
7-butyl-7-ethyltetradecane
CID 174665936
2-butyl-2-ethylpropane-1,3-diol
CID 87084275
2-butyl-2-ethylhexan-1-amine
CID 62725100
2,2-diethylhexylphosphane
CID 150041193
4-(bromomethyl)-4-ethyl-1-ethylsulfonyloctane
CID 66048272
5-(bromomethyl)-5-ethyldecane
CID 66050234
10,10-dibutylicosane
CID 151498539
2-butyl-2-ethyldodecan-1-amine
CID 55195465
5-(chloromethyl)-5-ethyldodecane
CID 66036047

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-5-(nitrosomethyl)nonane?
The IUPAC name of 5-ethyl-5-(nitrosomethyl)nonane (CID 118288001) is 5-ethyl-5-(nitrosomethyl)nonane.
What is the SMILES notation for 5-ethyl-5-(nitrosomethyl)nonane?
The canonical SMILES for 5-ethyl-5-(nitrosomethyl)nonane is CCCCC(CC)(CCCC)CN=O.
What is the InChIKey of 5-ethyl-5-(nitrosomethyl)nonane?
The InChIKey is WREJYZFVUYKRIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-4-7-9-12(6-3,11-13-14)10-8-5-2/h4-11H2,1-3H3.
What are the key properties of 5-ethyl-5-(nitrosomethyl)nonane?
5-ethyl-5-(nitrosomethyl)nonane has a molecular weight of 199.34 g/mol, XLogP of 4.53, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-5-(nitrosomethyl)nonane is sourced from PubChem (CID 118288001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).