1-methyl-2-nitrosopiperidine

C6H12N2O — CID 23619348

IUPAC1-methyl-2-nitrosopiperidine
SMILESCN1CCCCC1N=O
InChIInChI=1S/C6H12N2O/c1-8-5-3-2-4-6(8)7-9/h6H,2-5H2,1H3
InChIKeyLAKFOXRVLSIANH-UHFFFAOYSA-N
MW128.18 g/mol
LogP1.19
Rot. Bonds1

About 1-methyl-2-nitrosopiperidine

1-methyl-2-nitrosopiperidine (PubChem CID 23619348) has the molecular formula C6H12N2O and a molecular weight of 128.18 g/mol. Its IUPAC name is 1-methyl-2-nitrosopiperidine.

Molecular Properties

Compound Name1-methyl-2-nitrosopiperidine
PubChem CID23619348
Molecular FormulaC6H12N2O
Molecular Weight128.18 g/mol
Exact Mass128.09
IUPAC Name1-methyl-2-nitrosopiperidine
SMILESCN1CCCCC1N=O
InChIInChI=1S/C6H12N2O/c1-8-5-3-2-4-6(8)7-9/h6H,2-5H2,1H3
InChIKeyLAKFOXRVLSIANH-UHFFFAOYSA-N
XLogP1.19
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.18
LogP ≤ 51.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-nitrosopiperidine?
The IUPAC name of 1-methyl-2-nitrosopiperidine (CID 23619348) is 1-methyl-2-nitrosopiperidine.
What is the SMILES notation for 1-methyl-2-nitrosopiperidine?
The canonical SMILES for 1-methyl-2-nitrosopiperidine is CN1CCCCC1N=O.
What is the InChIKey of 1-methyl-2-nitrosopiperidine?
The InChIKey is LAKFOXRVLSIANH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O/c1-8-5-3-2-4-6(8)7-9/h6H,2-5H2,1H3.
What are the key properties of 1-methyl-2-nitrosopiperidine?
1-methyl-2-nitrosopiperidine has a molecular weight of 128.18 g/mol, XLogP of 1.19, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-nitrosopiperidine is sourced from PubChem (CID 23619348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).