4-(3-nitrosopent-1-enyl)pyridine

C10H12N2O — CID 91292733

IUPAC4-(3-nitrosopent-1-enyl)pyridine
SMILESCCC(C=Cc1ccncc1)N=O
InChIInChI=1S/C10H12N2O/c1-2-10(12-13)4-3-9-5-7-11-8-6-9/h3-8,10H,2H2,1H3
InChIKeyLRGNHNIGKMSODF-UHFFFAOYSA-N
MW176.22 g/mol
LogP2.64
Rot. Bonds4

About 4-(3-nitrosopent-1-enyl)pyridine

4-(3-nitrosopent-1-enyl)pyridine (PubChem CID 91292733) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is 4-(3-nitrosopent-1-enyl)pyridine.

Molecular Properties

Compound Name4-(3-nitrosopent-1-enyl)pyridine
PubChem CID91292733
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC Name4-(3-nitrosopent-1-enyl)pyridine
SMILESCCC(C=Cc1ccncc1)N=O
InChIInChI=1S/C10H12N2O/c1-2-10(12-13)4-3-9-5-7-11-8-6-9/h3-8,10H,2H2,1H3
InChIKeyLRGNHNIGKMSODF-UHFFFAOYSA-N
XLogP2.64
TPSA42.32 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3-nitrosopent-1-enyl)pyridine?
The IUPAC name of 4-(3-nitrosopent-1-enyl)pyridine (CID 91292733) is 4-(3-nitrosopent-1-enyl)pyridine.
What is the SMILES notation for 4-(3-nitrosopent-1-enyl)pyridine?
The canonical SMILES for 4-(3-nitrosopent-1-enyl)pyridine is CCC(C=Cc1ccncc1)N=O.
What is the InChIKey of 4-(3-nitrosopent-1-enyl)pyridine?
The InChIKey is LRGNHNIGKMSODF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O/c1-2-10(12-13)4-3-9-5-7-11-8-6-9/h3-8,10H,2H2,1H3.
What are the key properties of 4-(3-nitrosopent-1-enyl)pyridine?
4-(3-nitrosopent-1-enyl)pyridine has a molecular weight of 176.22 g/mol, XLogP of 2.64, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-nitrosopent-1-enyl)pyridine is sourced from PubChem (CID 91292733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).