1-(4-nitrosophenyl)piperidine

C11H14N2O — CID 88954522

IUPAC1-(4-nitrosophenyl)piperidine
SMILESO=Nc1ccc(N2CCCCC2)cc1
InChIInChI=1S/C11H14N2O/c14-12-10-4-6-11(7-5-10)13-8-2-1-3-9-13/h4-7H,1-3,8-9H2
InChIKeyGTGPDKUMWURUBP-UHFFFAOYSA-N
MW190.25 g/mol
LogP3.07
Rot. Bonds2

About 1-(4-nitrosophenyl)piperidine

1-(4-nitrosophenyl)piperidine (PubChem CID 88954522) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 1-(4-nitrosophenyl)piperidine.

Molecular Properties

Compound Name1-(4-nitrosophenyl)piperidine
PubChem CID88954522
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name1-(4-nitrosophenyl)piperidine
SMILESO=Nc1ccc(N2CCCCC2)cc1
InChIInChI=1S/C11H14N2O/c14-12-10-4-6-11(7-5-10)13-8-2-1-3-9-13/h4-7H,1-3,8-9H2
InChIKeyGTGPDKUMWURUBP-UHFFFAOYSA-N
XLogP3.07
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

1,16-diazatricyclo[14.14.4.231,34]hexatriaconta-31,33,35-triene
CID 177496449
4-[[4-[(4-piperidin-1-ylphenyl)diazenyl]phenyl]diazenyl]benzoic acid
CID 129101829
phenyl-[4-[(4-pyrrolidin-1-ylphenyl)diazenyl]phenyl]diazene
CID 19011238
2-[4-(4-nitrosophenyl)piperazin-1-yl]ethanol;dihydrochloride
CID 19099001
[4-(azocan-1-yl)phenyl]-(4-nitrophenyl)diazene
CID 5152218
(4-piperidin-1-ylphenyl)-[4-(trifluoromethyl)phenyl]diazene
CID 71324632
N-(4-piperidin-1-ylphenyl)-1-thiophen-2-ylmethanimine
CID 961227
4-(azepan-1-yl)aniline;dihydrochloride
CID 16640674
4-(azepan-1-yl)aniline;hydrochloride
CID 6603137
1-[4-[2-(4-piperidin-1-ylphenyl)ethenyl]phenyl]piperidine
CID 56975979
1-(4-piperidin-1-ylphenyl)pyrrole-2,5-dione
CID 512832
2-methyl-N'-(4-piperidin-1-ylphenyl)propanimidamide
CID 63180778

Frequently Asked Questions

What is the IUPAC name of 1-(4-nitrosophenyl)piperidine?
The IUPAC name of 1-(4-nitrosophenyl)piperidine (CID 88954522) is 1-(4-nitrosophenyl)piperidine.
What is the SMILES notation for 1-(4-nitrosophenyl)piperidine?
The canonical SMILES for 1-(4-nitrosophenyl)piperidine is O=Nc1ccc(N2CCCCC2)cc1.
What is the InChIKey of 1-(4-nitrosophenyl)piperidine?
The InChIKey is GTGPDKUMWURUBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c14-12-10-4-6-11(7-5-10)13-8-2-1-3-9-13/h4-7H,1-3,8-9H2.
What are the key properties of 1-(4-nitrosophenyl)piperidine?
1-(4-nitrosophenyl)piperidine has a molecular weight of 190.25 g/mol, XLogP of 3.07, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-nitrosophenyl)piperidine is sourced from PubChem (CID 88954522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).