5-(1-methylpyrrolidin-2-yl)-2-nitrosopyridine

C10H13N3O — CID 142692087

IUPAC5-(1-methylpyrrolidin-2-yl)-2-nitrosopyridine
SMILESCN1CCCC1c1ccc(N=O)nc1
InChIInChI=1S/C10H13N3O/c1-13-6-2-3-9(13)8-4-5-10(12-14)11-7-8/h4-5,7,9H,2-3,6H2,1H3
InChIKeyALJXLZZGCGIWME-UHFFFAOYSA-N
MW191.23 g/mol
LogP2.25
Rot. Bonds2

About 5-(1-methylpyrrolidin-2-yl)-2-nitrosopyridine

5-(1-methylpyrrolidin-2-yl)-2-nitrosopyridine (PubChem CID 142692087) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is 5-(1-methylpyrrolidin-2-yl)-2-nitrosopyridine.

Molecular Properties

Compound Name5-(1-methylpyrrolidin-2-yl)-2-nitrosopyridine
PubChem CID142692087
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC Name5-(1-methylpyrrolidin-2-yl)-2-nitrosopyridine
SMILESCN1CCCC1c1ccc(N=O)nc1
InChIInChI=1S/C10H13N3O/c1-13-6-2-3-9(13)8-4-5-10(12-14)11-7-8/h4-5,7,9H,2-3,6H2,1H3
InChIKeyALJXLZZGCGIWME-UHFFFAOYSA-N
XLogP2.25
TPSA45.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(1-methylpyrrolidin-2-yl)-2-nitrosopyridine?
The IUPAC name of 5-(1-methylpyrrolidin-2-yl)-2-nitrosopyridine (CID 142692087) is 5-(1-methylpyrrolidin-2-yl)-2-nitrosopyridine.
What is the SMILES notation for 5-(1-methylpyrrolidin-2-yl)-2-nitrosopyridine?
The canonical SMILES for 5-(1-methylpyrrolidin-2-yl)-2-nitrosopyridine is CN1CCCC1c1ccc(N=O)nc1.
What is the InChIKey of 5-(1-methylpyrrolidin-2-yl)-2-nitrosopyridine?
The InChIKey is ALJXLZZGCGIWME-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O/c1-13-6-2-3-9(13)8-4-5-10(12-14)11-7-8/h4-5,7,9H,2-3,6H2,1H3.
What are the key properties of 5-(1-methylpyrrolidin-2-yl)-2-nitrosopyridine?
5-(1-methylpyrrolidin-2-yl)-2-nitrosopyridine has a molecular weight of 191.23 g/mol, XLogP of 2.25, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methylpyrrolidin-2-yl)-2-nitrosopyridine is sourced from PubChem (CID 142692087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).