N-(1-methyl-8-azabicyclo[3.2.1]octan-3-ylidene)hydroxylamine

C8H14N2O — CID 150321493

IUPACN-(1-methyl-8-azabicyclo[3.2.1]octan-3-ylidene)hydroxylamine
SMILESCC12CCC(CC(=NO)C1)N2
InChIInChI=1S/C8H14N2O/c1-8-3-2-6(9-8)4-7(5-8)10-11/h6,9,11H,2-5H2,1H3
InChIKeyGNSPITWQXVTIHE-UHFFFAOYSA-N
MW154.21 g/mol
LogP1.12
Rot. Bonds

About N-(1-methyl-8-azabicyclo[3.2.1]octan-3-ylidene)hydroxylamine

N-(1-methyl-8-azabicyclo[3.2.1]octan-3-ylidene)hydroxylamine (PubChem CID 150321493) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is N-(1-methyl-8-azabicyclo[3.2.1]octan-3-ylidene)hydroxylamine.

Molecular Properties

Compound NameN-(1-methyl-8-azabicyclo[3.2.1]octan-3-ylidene)hydroxylamine
PubChem CID150321493
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC NameN-(1-methyl-8-azabicyclo[3.2.1]octan-3-ylidene)hydroxylamine
SMILESCC12CCC(CC(=NO)C1)N2
InChIInChI=1S/C8H14N2O/c1-8-3-2-6(9-8)4-7(5-8)10-11/h6,9,11H,2-5H2,1H3
InChIKeyGNSPITWQXVTIHE-UHFFFAOYSA-N
XLogP1.12
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

N-(1,5-dimethyl-9-azabicyclo[3.3.1]nonan-3-ylidene)hydroxylamine
CID 154988128
1-methyl-9-azabicyclo[4.2.1]nonane
CID 15440314
(NZ)-N-[(3aS,7aS)-4,4,7a-trimethyl-1,3,3a,5,6,7-hexahydroinden-2-ylidene]hydroxylamine
CID 71553284
1-methyl-11-azabicyclo[6.2.1]undecane
CID 134467072
N-[(1S)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene]hydroxylamine
CID 45157399
(NZ)-N-[(3Z,5S,8R,9S,10S,13S,14S)-3-hydroxyimino-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-ylidene]hydroxylamine
CID 99569058
N-[(3E,5S,10S,13S)-3-hydroxyimino-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-ylidene]hydroxylamine
CID 172916707
N-methyl-8-azabicyclo[3.2.1]octan-3-imine
CID 131851589
1-methyl-6-azabicyclo[3.1.1]heptane
CID 144585149
N-[(3R)-3-methylcyclopentylidene]hydroxylamine
CID 140972581
(NE)-N-(3-methylcyclopentylidene)hydroxylamine
CID 12768212
N-(7-hydroxyimino-9,9-dimethoxy-3-bicyclo[3.3.1]nonanylidene)hydroxylamine
CID 15262063

Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-8-azabicyclo[3.2.1]octan-3-ylidene)hydroxylamine?
The IUPAC name of N-(1-methyl-8-azabicyclo[3.2.1]octan-3-ylidene)hydroxylamine (CID 150321493) is N-(1-methyl-8-azabicyclo[3.2.1]octan-3-ylidene)hydroxylamine.
What is the SMILES notation for N-(1-methyl-8-azabicyclo[3.2.1]octan-3-ylidene)hydroxylamine?
The canonical SMILES for N-(1-methyl-8-azabicyclo[3.2.1]octan-3-ylidene)hydroxylamine is CC12CCC(CC(=NO)C1)N2.
What is the InChIKey of N-(1-methyl-8-azabicyclo[3.2.1]octan-3-ylidene)hydroxylamine?
The InChIKey is GNSPITWQXVTIHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-8-3-2-6(9-8)4-7(5-8)10-11/h6,9,11H,2-5H2,1H3.
What are the key properties of N-(1-methyl-8-azabicyclo[3.2.1]octan-3-ylidene)hydroxylamine?
N-(1-methyl-8-azabicyclo[3.2.1]octan-3-ylidene)hydroxylamine has a molecular weight of 154.21 g/mol, XLogP of 1.12, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-8-azabicyclo[3.2.1]octan-3-ylidene)hydroxylamine is sourced from PubChem (CID 150321493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).