N-(3-hydroxyimino-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine

C10H16N2O2 — CID 135462656

IUPACN-(3-hydroxyimino-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine
SMILESCC12CCC(C(=NO)C1=NO)C2(C)C
InChIInChI=1S/C10H16N2O2/c1-9(2)6-4-5-10(9,3)8(12-14)7(6)11-13/h6,13-14H,4-5H2,1-3H3
InChIKeyJCFJSQZXNOMXCP-UHFFFAOYSA-N
MW196.25 g/mol
LogP2.10
Rot. Bonds

About N-(3-hydroxyimino-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine

N-(3-hydroxyimino-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine (PubChem CID 135462656) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is N-(3-hydroxyimino-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine.

Molecular Properties

Compound NameN-(3-hydroxyimino-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine
PubChem CID135462656
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC NameN-(3-hydroxyimino-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine
SMILESCC12CCC(C(=NO)C1=NO)C2(C)C
InChIInChI=1S/C10H16N2O2/c1-9(2)6-4-5-10(9,3)8(12-14)7(6)11-13/h6,13-14H,4-5H2,1-3H3
InChIKeyJCFJSQZXNOMXCP-UHFFFAOYSA-N
XLogP2.10
TPSA65.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_one_A(321)', 'substructure': 'N/A'}, {'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 N-(3-hydroxyimino-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine?
The IUPAC name of N-(3-hydroxyimino-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine (CID 135462656) is N-(3-hydroxyimino-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine.
What is the SMILES notation for N-(3-hydroxyimino-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine?
The canonical SMILES for N-(3-hydroxyimino-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine is CC12CCC(C(=NO)C1=NO)C2(C)C.
What is the InChIKey of N-(3-hydroxyimino-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine?
The InChIKey is JCFJSQZXNOMXCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-9(2)6-4-5-10(9,3)8(12-14)7(6)11-13/h6,13-14H,4-5H2,1-3H3.
What are the key properties of N-(3-hydroxyimino-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine?
N-(3-hydroxyimino-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine has a molecular weight of 196.25 g/mol, XLogP of 2.10, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxyimino-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine is sourced from PubChem (CID 135462656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).