4-(3-nitrosophenyl)piperidine

C11H14N2O — CID 142849133

IUPAC4-(3-nitrosophenyl)piperidine
SMILESO=Nc1cccc(C2CCNCC2)c1
InChIInChI=1S/C11H14N2O/c14-13-11-3-1-2-10(8-11)9-4-6-12-7-5-9/h1-3,8-9,12H,4-7H2
InChIKeyNKLJMLYHWUZODB-UHFFFAOYSA-N
MW190.25 g/mol
LogP2.55
Rot. Bonds2

About 4-(3-nitrosophenyl)piperidine

4-(3-nitrosophenyl)piperidine (PubChem CID 142849133) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 4-(3-nitrosophenyl)piperidine.

Molecular Properties

Compound Name4-(3-nitrosophenyl)piperidine
PubChem CID142849133
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name4-(3-nitrosophenyl)piperidine
SMILESO=Nc1cccc(C2CCNCC2)c1
InChIInChI=1S/C11H14N2O/c14-13-11-3-1-2-10(8-11)9-4-6-12-7-5-9/h1-3,8-9,12H,4-7H2
InChIKeyNKLJMLYHWUZODB-UHFFFAOYSA-N
XLogP2.55
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-piperidin-4-ylphenyl)piperidine
CID 91123464
4-(3-bromophenyl)piperidine;hydrochloride
CID 46735221
4-(3-phenylphenyl)piperidine
CID 54258001
4-[3-(4,4-dimethylcyclohexyl)phenyl]piperidine
CID 117431735
2-(3-piperidin-4-ylphenyl)pyrimidine
CID 91370651
4-phenylpiperidine;sulfane;hydrochloride
CID 174499697
4-(3-piperidin-4-ylphenyl)morpholine
CID 117368717
N-methyl-N-(3-piperidin-4-ylphenyl)methanesulfonamide
CID 117424883
methanamine;4-phenylpiperidine
CID 143444696
3-(azepan-4-yl)benzonitrile
CID 141182585
4-[3-(2,2,2-trifluoroethyl)phenyl]piperidine
CID 84703850
N-methyl-N-methylsulfanyl-3-piperidin-4-ylaniline
CID 155107747

Frequently Asked Questions

What is the IUPAC name of 4-(3-nitrosophenyl)piperidine?
The IUPAC name of 4-(3-nitrosophenyl)piperidine (CID 142849133) is 4-(3-nitrosophenyl)piperidine.
What is the SMILES notation for 4-(3-nitrosophenyl)piperidine?
The canonical SMILES for 4-(3-nitrosophenyl)piperidine is O=Nc1cccc(C2CCNCC2)c1.
What is the InChIKey of 4-(3-nitrosophenyl)piperidine?
The InChIKey is NKLJMLYHWUZODB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c14-13-11-3-1-2-10(8-11)9-4-6-12-7-5-9/h1-3,8-9,12H,4-7H2.
What are the key properties of 4-(3-nitrosophenyl)piperidine?
4-(3-nitrosophenyl)piperidine has a molecular weight of 190.25 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-nitrosophenyl)piperidine is sourced from PubChem (CID 142849133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).