4-nitroso-2-azatricyclo[3.3.1.03,7]nonane

C8H12N2O — CID 177003359

IUPAC4-nitroso-2-azatricyclo[3.3.1.03,7]nonane
SMILESO=NC1C2CC3CC(C2)C1N3
InChIInChI=1S/C8H12N2O/c11-10-8-5-1-4-2-6(3-5)9-7(4)8/h4-9H,1-3H2
InChIKeyMIUNMGSQPABFDH-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.89
Rot. Bonds1

About 4-nitroso-2-azatricyclo[3.3.1.03,7]nonane

4-nitroso-2-azatricyclo[3.3.1.03,7]nonane (PubChem CID 177003359) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 4-nitroso-2-azatricyclo[3.3.1.03,7]nonane.

Molecular Properties

Compound Name4-nitroso-2-azatricyclo[3.3.1.03,7]nonane
PubChem CID177003359
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name4-nitroso-2-azatricyclo[3.3.1.03,7]nonane
SMILESO=NC1C2CC3CC(C2)C1N3
InChIInChI=1S/C8H12N2O/c11-10-8-5-1-4-2-6(3-5)9-7(4)8/h4-9H,1-3H2
InChIKeyMIUNMGSQPABFDH-UHFFFAOYSA-N
XLogP0.89
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,10-dichloro-2-azatricyclo[3.3.1.13,7]decane
CID 130020808
2-nitrosoadamantane
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(1S,2R,3S,4S)-2-bromo-3-nitrosobicyclo[2.2.1]heptane
CID 98513283
2-azabicyclo[2.1.1]hexane-3-carboxylic acid
CID 83814998
6'-nitrosospiro[1,3-dioxolane-2,2'-adamantane]
CID 90801410
3-cyclopropyl-8-azabicyclo[3.2.1]octane
CID 105429641
3,21-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosane
CID 59063341
(3S)-2-azabicyclo[2.1.1]hexane-3-carboxylic acid;2,2,2-trifluoroacetic acid
CID 129315011
1-nitroso-2-azatricyclo[3.3.1.13,7]decane
CID 118643342
(1S,3R,4R)-2-azabicyclo[2.2.1]heptane-3-carbonyl chloride
CID 57358634
2-azatricyclo[3.3.1.13,7]decane-4-carboxylic acid
CID 141371405
3-azabicyclo[3.1.1]heptane-2,4-diol
CID 176808697

Frequently Asked Questions

What is the IUPAC name of 4-nitroso-2-azatricyclo[3.3.1.03,7]nonane?
The IUPAC name of 4-nitroso-2-azatricyclo[3.3.1.03,7]nonane (CID 177003359) is 4-nitroso-2-azatricyclo[3.3.1.03,7]nonane.
What is the SMILES notation for 4-nitroso-2-azatricyclo[3.3.1.03,7]nonane?
The canonical SMILES for 4-nitroso-2-azatricyclo[3.3.1.03,7]nonane is O=NC1C2CC3CC(C2)C1N3.
What is the InChIKey of 4-nitroso-2-azatricyclo[3.3.1.03,7]nonane?
The InChIKey is MIUNMGSQPABFDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c11-10-8-5-1-4-2-6(3-5)9-7(4)8/h4-9H,1-3H2.
What are the key properties of 4-nitroso-2-azatricyclo[3.3.1.03,7]nonane?
4-nitroso-2-azatricyclo[3.3.1.03,7]nonane has a molecular weight of 152.20 g/mol, XLogP of 0.89, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-nitroso-2-azatricyclo[3.3.1.03,7]nonane is sourced from PubChem (CID 177003359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).