(NE)-N-(3-tricyclo[5.2.1.02,6]deca-4,8-dienylidene)hydroxylamine

C10H11NO — CID 166475474

IUPAC(NE)-N-(3-tricyclo[5.2.1.02,6]deca-4,8-dienylidene)hydroxylamine
SMILESO/N=C1\C=CC2C3C=CC(C3)C12
InChIInChI=1S/C10H11NO/c12-11-9-4-3-8-6-1-2-7(5-6)10(8)9/h1-4,6-8,10,12H,5H2/b11-9+
InChIKeyQUSWFFJVUFHQAC-PKNBQFBNSA-N
MW161.20 g/mol
LogP1.82
Rot. Bonds

About (NE)-N-(3-tricyclo[5.2.1.02,6]deca-4,8-dienylidene)hydroxylamine

(NE)-N-(3-tricyclo[5.2.1.02,6]deca-4,8-dienylidene)hydroxylamine (PubChem CID 166475474) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is (NE)-N-(3-tricyclo[5.2.1.02,6]deca-4,8-dienylidene)hydroxylamine.

Molecular Properties

Compound Name(NE)-N-(3-tricyclo[5.2.1.02,6]deca-4,8-dienylidene)hydroxylamine
PubChem CID166475474
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name(NE)-N-(3-tricyclo[5.2.1.02,6]deca-4,8-dienylidene)hydroxylamine
SMILESO/N=C1\C=CC2C3C=CC(C3)C12
InChIInChI=1S/C10H11NO/c12-11-9-4-3-8-6-1-2-7(5-6)10(8)9/h1-4,6-8,10,12H,5H2/b11-9+
InChIKeyQUSWFFJVUFHQAC-PKNBQFBNSA-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': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Ethanone, 1-bicyclo(2.2.1)hept-5-en-2-yl-, oxime
CID 103386
1-Bicyclo(2.2.1)hept-5-en-2-ylethan-1-one oxime
CID 5365542
Bicyclo [2.2.1] hept-2-ene-5-yl,methyl oxime
CID 5484595
1-(2-bicyclo[2.2.1]hept-5-enyl)-N-methoxyethanimine
CID 155724572
(NE)-N-[1-[(1R,2R,4R)-2-bicyclo[2.2.1]hept-5-enyl]ethylidene]hydroxylamine
CID 98174711
1,3a,4,6,7,7a-Hexahydro-4,7-methanoinden-5-one oxime
CID 242258
N-(5-hydroxyimino-10-tricyclo[5.2.1.02,6]deca-3,8-dienylidene)hydroxylamine
CID 4110919
(NE)-N-(8-tricyclo[5.2.1.02,6]dec-4-enylidene)hydroxylamine
CID 9561406
(NE)-N-[(3aR,7aR)-2,3,3a,4,7,7a-hexahydroinden-1-ylidene]hydroxylamine
CID 15408147
8-Hydroxyimino-cis-bicyclo[4,3,0]nona-3-ene
CID 18599125
(NZ)-N-[1-(2-bicyclo[2.2.1]hept-5-enyl)-3-ethylpentylidene]hydroxylamine
CID 18669648
N-(9-bicyclo[4.2.1]non-3-enylidene)hydroxylamine
CID 21882782

Frequently Asked Questions

What is the IUPAC name of (NE)-N-(3-tricyclo[5.2.1.02,6]deca-4,8-dienylidene)hydroxylamine?
The IUPAC name of (NE)-N-(3-tricyclo[5.2.1.02,6]deca-4,8-dienylidene)hydroxylamine (CID 166475474) is (NE)-N-(3-tricyclo[5.2.1.02,6]deca-4,8-dienylidene)hydroxylamine.
What is the SMILES notation for (NE)-N-(3-tricyclo[5.2.1.02,6]deca-4,8-dienylidene)hydroxylamine?
The canonical SMILES for (NE)-N-(3-tricyclo[5.2.1.02,6]deca-4,8-dienylidene)hydroxylamine is O/N=C1\C=CC2C3C=CC(C3)C12.
What is the InChIKey of (NE)-N-(3-tricyclo[5.2.1.02,6]deca-4,8-dienylidene)hydroxylamine?
The InChIKey is QUSWFFJVUFHQAC-PKNBQFBNSA-N. The full InChI is InChI=1S/C10H11NO/c12-11-9-4-3-8-6-1-2-7(5-6)10(8)9/h1-4,6-8,10,12H,5H2/b11-9+.
What are the key properties of (NE)-N-(3-tricyclo[5.2.1.02,6]deca-4,8-dienylidene)hydroxylamine?
(NE)-N-(3-tricyclo[5.2.1.02,6]deca-4,8-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 (NE)-N-(3-tricyclo[5.2.1.02,6]deca-4,8-dienylidene)hydroxylamine is sourced from PubChem (CID 166475474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).