(NZ)-N-[(1R,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]octanylidene]hydroxylamine

C11H19NO — CID 23376293

IUPAC(NZ)-N-[(1R,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]octanylidene]hydroxylamine
SMILESCC1(C)[C@@H]2CC/C(=N/O)[C@]1(C)CC2
InChIInChI=1S/C11H19NO/c1-10(2)8-4-5-9(12-13)11(10,3)7-6-8/h8,13H,4-7H2,1-3H3/b12-9-/t8-,11+/m1/s1
InChIKeyJOQZFTCJRGOUEB-KCNKPFSRSA-N
MW181.28 g/mol
LogP3.05
Rot. Bonds

About (NZ)-N-[(1R,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]octanylidene]hydroxylamine

(NZ)-N-[(1R,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]octanylidene]hydroxylamine (PubChem CID 23376293) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is (NZ)-N-[(1R,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]octanylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[(1R,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]octanylidene]hydroxylamine
PubChem CID23376293
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name(NZ)-N-[(1R,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]octanylidene]hydroxylamine
SMILESCC1(C)[C@@H]2CC/C(=N/O)[C@]1(C)CC2
InChIInChI=1S/C11H19NO/c1-10(2)8-4-5-9(12-13)11(10,3)7-6-8/h8,13H,4-7H2,1-3H3/b12-9-/t8-,11+/m1/s1
InChIKeyJOQZFTCJRGOUEB-KCNKPFSRSA-N
XLogP3.05
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 53.05
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,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]octanylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[(1R,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]octanylidene]hydroxylamine (CID 23376293) is (NZ)-N-[(1R,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]octanylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[(1R,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]octanylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[(1R,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]octanylidene]hydroxylamine is CC1(C)[C@@H]2CC/C(=N/O)[C@]1(C)CC2.
What is the InChIKey of (NZ)-N-[(1R,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]octanylidene]hydroxylamine?
The InChIKey is JOQZFTCJRGOUEB-KCNKPFSRSA-N. The full InChI is InChI=1S/C11H19NO/c1-10(2)8-4-5-9(12-13)11(10,3)7-6-8/h8,13H,4-7H2,1-3H3/b12-9-/t8-,11+/m1/s1.
What are the key properties of (NZ)-N-[(1R,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]octanylidene]hydroxylamine?
(NZ)-N-[(1R,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]octanylidene]hydroxylamine has a molecular weight of 181.28 g/mol, XLogP of 3.05, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[(1R,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]octanylidene]hydroxylamine is sourced from PubChem (CID 23376293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).