(NZ)-N-[(1S,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]oct-3-enylidene]hydroxylamine

C11H17NO — CID 7159542

IUPAC(NZ)-N-[(1S,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]oct-3-enylidene]hydroxylamine
SMILESCC1(C)[C@@H]2C=C/C(=N/O)[C@@]1(C)CC2
InChIInChI=1S/C11H17NO/c1-10(2)8-4-5-9(12-13)11(10,3)7-6-8/h4-5,8,13H,6-7H2,1-3H3/b12-9-/t8-,11-/m1/s1
InChIKeyVVLVKIUAFXAMBW-WPUBFWNISA-N
MW179.26 g/mol
LogP2.83
Rot. Bonds

About (NZ)-N-[(1S,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]oct-3-enylidene]hydroxylamine

(NZ)-N-[(1S,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]oct-3-enylidene]hydroxylamine (PubChem CID 7159542) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is (NZ)-N-[(1S,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]oct-3-enylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[(1S,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]oct-3-enylidene]hydroxylamine
PubChem CID7159542
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name(NZ)-N-[(1S,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]oct-3-enylidene]hydroxylamine
SMILESCC1(C)[C@@H]2C=C/C(=N/O)[C@@]1(C)CC2
InChIInChI=1S/C11H17NO/c1-10(2)8-4-5-9(12-13)11(10,3)7-6-8/h4-5,8,13H,6-7H2,1-3H3/b12-9-/t8-,11-/m1/s1
InChIKeyVVLVKIUAFXAMBW-WPUBFWNISA-N
XLogP2.83
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 52.83
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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Related Compounds

(1R,5S)-1,8,8-trimethylbicyclo[3.2.1]oct-3-en-2-one
CID 23310174
(1S,4R)-1,2,7,7-tetramethylbicyclo[2.2.1]hept-2-ene
CID 71442839
(1R,4R)-1,7,7-trimethyl-2-[[(1R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]hept-2-enyl]ditellanyl]bicyclo[2.2.1]hept-2-ene
CID 122369565
N-[(1S)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene]hydroxylamine
CID 45157399
(1R,3E,4S)-3-hydroxyimino-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one
CID 7271809
(1R)-1,7,7-trimethyl-2-methylsulfanylbicyclo[2.2.1]hept-2-ene
CID 71443158
(NZ)-N-[(1R,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]octanylidene]hydroxylamine
CID 23376293
hexakis(N-(3-hydroxyimino-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine);nickel;silver
CID 135462655
(NE)-N-(3-amino-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine
CID 6370104
N-(3-amino-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine
CID 2750642
N-(1,7,7-trimethyl-3-pyridin-1-ium-1-yl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine
CID 3847818
[(1S,2S,3E,4R)-3-hydroxyimino-4,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] selenohypobromite
CID 10903459

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[(1S,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]oct-3-enylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[(1S,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]oct-3-enylidene]hydroxylamine (CID 7159542) is (NZ)-N-[(1S,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]oct-3-enylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[(1S,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]oct-3-enylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[(1S,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]oct-3-enylidene]hydroxylamine is CC1(C)[C@@H]2C=C/C(=N/O)[C@@]1(C)CC2.
What is the InChIKey of (NZ)-N-[(1S,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]oct-3-enylidene]hydroxylamine?
The InChIKey is VVLVKIUAFXAMBW-WPUBFWNISA-N. The full InChI is InChI=1S/C11H17NO/c1-10(2)8-4-5-9(12-13)11(10,3)7-6-8/h4-5,8,13H,6-7H2,1-3H3/b12-9-/t8-,11-/m1/s1.
What are the key properties of (NZ)-N-[(1S,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]oct-3-enylidene]hydroxylamine?
(NZ)-N-[(1S,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]oct-3-enylidene]hydroxylamine has a molecular weight of 179.26 g/mol, XLogP of 2.83, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[(1S,5S)-1,8,8-trimethyl-2-bicyclo[3.2.1]oct-3-enylidene]hydroxylamine is sourced from PubChem (CID 7159542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).