(NZ)-N-[(1R,2S,7S,10R)-9-tricyclo[5.3.0.02,10]deca-3,5-dienylidene]hydroxylamine

C10H11NO — CID 119078569

IUPAC(NZ)-N-[(1R,2S,7S,10R)-9-tricyclo[5.3.0.02,10]deca-3,5-dienylidene]hydroxylamine
SMILESO/N=C1/C[C@H]2C=CC=C[C@@H]3[C@@H]1[C@@H]32
InChIInChI=1S/C10H11NO/c12-11-8-5-6-3-1-2-4-7-9(6)10(7)8/h1-4,6-7,9-10,12H,5H2/b11-8-/t6-,7+,9-,10+/m1/s1
InChIKeyUJVAVIPXGGHSMT-MAUHWPIPSA-N
MW161.20 g/mol
LogP1.82
Rot. Bonds

About (NZ)-N-[(1R,2S,7S,10R)-9-tricyclo[5.3.0.02,10]deca-3,5-dienylidene]hydroxylamine

(NZ)-N-[(1R,2S,7S,10R)-9-tricyclo[5.3.0.02,10]deca-3,5-dienylidene]hydroxylamine (PubChem CID 119078569) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is (NZ)-N-[(1R,2S,7S,10R)-9-tricyclo[5.3.0.02,10]deca-3,5-dienylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[(1R,2S,7S,10R)-9-tricyclo[5.3.0.02,10]deca-3,5-dienylidene]hydroxylamine
PubChem CID119078569
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name(NZ)-N-[(1R,2S,7S,10R)-9-tricyclo[5.3.0.02,10]deca-3,5-dienylidene]hydroxylamine
SMILESO/N=C1/C[C@H]2C=CC=C[C@@H]3[C@@H]1[C@@H]32
InChIInChI=1S/C10H11NO/c12-11-8-5-6-3-1-2-4-7-9(6)10(7)8/h1-4,6-7,9-10,12H,5H2/b11-8-/t6-,7+,9-,10+/m1/s1
InChIKeyUJVAVIPXGGHSMT-MAUHWPIPSA-N
XLogP1.82
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[(1R,2S,7S,10R)-9-tricyclo[5.3.0.02,10]deca-3,5-dienylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[(1R,2S,7S,10R)-9-tricyclo[5.3.0.02,10]deca-3,5-dienylidene]hydroxylamine (CID 119078569) is (NZ)-N-[(1R,2S,7S,10R)-9-tricyclo[5.3.0.02,10]deca-3,5-dienylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[(1R,2S,7S,10R)-9-tricyclo[5.3.0.02,10]deca-3,5-dienylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[(1R,2S,7S,10R)-9-tricyclo[5.3.0.02,10]deca-3,5-dienylidene]hydroxylamine is O/N=C1/C[C@H]2C=CC=C[C@@H]3[C@@H]1[C@@H]32.
What is the InChIKey of (NZ)-N-[(1R,2S,7S,10R)-9-tricyclo[5.3.0.02,10]deca-3,5-dienylidene]hydroxylamine?
The InChIKey is UJVAVIPXGGHSMT-MAUHWPIPSA-N. The full InChI is InChI=1S/C10H11NO/c12-11-8-5-6-3-1-2-4-7-9(6)10(7)8/h1-4,6-7,9-10,12H,5H2/b11-8-/t6-,7+,9-,10+/m1/s1.
What are the key properties of (NZ)-N-[(1R,2S,7S,10R)-9-tricyclo[5.3.0.02,10]deca-3,5-dienylidene]hydroxylamine?
(NZ)-N-[(1R,2S,7S,10R)-9-tricyclo[5.3.0.02,10]deca-3,5-dienylidene]hydroxylamine has a molecular weight of 161.20 g/mol, XLogP of 1.82, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[(1R,2S,7S,10R)-9-tricyclo[5.3.0.02,10]deca-3,5-dienylidene]hydroxylamine is sourced from PubChem (CID 119078569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).