2-methoxy-5-[(Z)-2-nitrosoprop-1-enyl]pyridine

C9H10N2O2 — CID 89164549

IUPAC2-methoxy-5-[(Z)-2-nitrosoprop-1-enyl]pyridine
SMILESCOc1ccc(/C=C(/C)N=O)cn1
InChIInChI=1S/C9H10N2O2/c1-7(11-12)5-8-3-4-9(13-2)10-6-8/h3-6H,1-2H3/b7-5-
InChIKeyGOJCHFMSYULXNV-ALCCZGGFSA-N
MW178.19 g/mol
LogP2.22
Rot. Bonds3

About 2-methoxy-5-[(Z)-2-nitrosoprop-1-enyl]pyridine

2-methoxy-5-[(Z)-2-nitrosoprop-1-enyl]pyridine (PubChem CID 89164549) has the molecular formula C9H10N2O2 and a molecular weight of 178.19 g/mol. Its IUPAC name is 2-methoxy-5-[(Z)-2-nitrosoprop-1-enyl]pyridine.

Molecular Properties

Compound Name2-methoxy-5-[(Z)-2-nitrosoprop-1-enyl]pyridine
PubChem CID89164549
Molecular FormulaC9H10N2O2
Molecular Weight178.19 g/mol
Exact Mass178.07
IUPAC Name2-methoxy-5-[(Z)-2-nitrosoprop-1-enyl]pyridine
SMILESCOc1ccc(/C=C(/C)N=O)cn1
InChIInChI=1S/C9H10N2O2/c1-7(11-12)5-8-3-4-9(13-2)10-6-8/h3-6H,1-2H3/b7-5-
InChIKeyGOJCHFMSYULXNV-ALCCZGGFSA-N
XLogP2.22
TPSA51.55 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.19
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-[(Z)-2-nitrosoprop-1-enyl]pyridine?
The IUPAC name of 2-methoxy-5-[(Z)-2-nitrosoprop-1-enyl]pyridine (CID 89164549) is 2-methoxy-5-[(Z)-2-nitrosoprop-1-enyl]pyridine.
What is the SMILES notation for 2-methoxy-5-[(Z)-2-nitrosoprop-1-enyl]pyridine?
The canonical SMILES for 2-methoxy-5-[(Z)-2-nitrosoprop-1-enyl]pyridine is COc1ccc(/C=C(/C)N=O)cn1.
What is the InChIKey of 2-methoxy-5-[(Z)-2-nitrosoprop-1-enyl]pyridine?
The InChIKey is GOJCHFMSYULXNV-ALCCZGGFSA-N. The full InChI is InChI=1S/C9H10N2O2/c1-7(11-12)5-8-3-4-9(13-2)10-6-8/h3-6H,1-2H3/b7-5-.
What are the key properties of 2-methoxy-5-[(Z)-2-nitrosoprop-1-enyl]pyridine?
2-methoxy-5-[(Z)-2-nitrosoprop-1-enyl]pyridine has a molecular weight of 178.19 g/mol, XLogP of 2.22, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-[(Z)-2-nitrosoprop-1-enyl]pyridine is sourced from PubChem (CID 89164549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).