5-ethyl-2-methyl-3-nitroso-4-(nitrosomethyl)pyridine

C9H11N3O2 — CID 126621147

IUPAC5-ethyl-2-methyl-3-nitroso-4-(nitrosomethyl)pyridine
SMILESCCc1cnc(C)c(N=O)c1CN=O
InChIInChI=1S/C9H11N3O2/c1-3-7-4-10-6(2)9(12-14)8(7)5-11-13/h4H,3,5H2,1-2H3
InChIKeySUICVIKMYVXJKD-UHFFFAOYSA-N
MW193.21 g/mol
LogP2.62
Rot. Bonds4

About 5-ethyl-2-methyl-3-nitroso-4-(nitrosomethyl)pyridine

5-ethyl-2-methyl-3-nitroso-4-(nitrosomethyl)pyridine (PubChem CID 126621147) has the molecular formula C9H11N3O2 and a molecular weight of 193.21 g/mol. Its IUPAC name is 5-ethyl-2-methyl-3-nitroso-4-(nitrosomethyl)pyridine.

Molecular Properties

Compound Name5-ethyl-2-methyl-3-nitroso-4-(nitrosomethyl)pyridine
PubChem CID126621147
Molecular FormulaC9H11N3O2
Molecular Weight193.21 g/mol
Exact Mass193.09
IUPAC Name5-ethyl-2-methyl-3-nitroso-4-(nitrosomethyl)pyridine
SMILESCCc1cnc(C)c(N=O)c1CN=O
InChIInChI=1S/C9H11N3O2/c1-3-7-4-10-6(2)9(12-14)8(7)5-11-13/h4H,3,5H2,1-2H3
InChIKeySUICVIKMYVXJKD-UHFFFAOYSA-N
XLogP2.62
TPSA71.75 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-methyl-3-nitroso-4-(nitrosomethyl)pyridine?
The IUPAC name of 5-ethyl-2-methyl-3-nitroso-4-(nitrosomethyl)pyridine (CID 126621147) is 5-ethyl-2-methyl-3-nitroso-4-(nitrosomethyl)pyridine.
What is the SMILES notation for 5-ethyl-2-methyl-3-nitroso-4-(nitrosomethyl)pyridine?
The canonical SMILES for 5-ethyl-2-methyl-3-nitroso-4-(nitrosomethyl)pyridine is CCc1cnc(C)c(N=O)c1CN=O.
What is the InChIKey of 5-ethyl-2-methyl-3-nitroso-4-(nitrosomethyl)pyridine?
The InChIKey is SUICVIKMYVXJKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O2/c1-3-7-4-10-6(2)9(12-14)8(7)5-11-13/h4H,3,5H2,1-2H3.
What are the key properties of 5-ethyl-2-methyl-3-nitroso-4-(nitrosomethyl)pyridine?
5-ethyl-2-methyl-3-nitroso-4-(nitrosomethyl)pyridine has a molecular weight of 193.21 g/mol, XLogP of 2.62, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-methyl-3-nitroso-4-(nitrosomethyl)pyridine is sourced from PubChem (CID 126621147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).