(NZ)-N-(3-indol-1-yl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine

C15H16N2O — CID 20788489

IUPAC(NZ)-N-(3-indol-1-yl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine
SMILESO/N=C1/C2CCC(C2)C1n1ccc2ccccc21
InChIInChI=1S/C15H16N2O/c18-16-14-11-5-6-12(9-11)15(14)17-8-7-10-3-1-2-4-13(10)17/h1-4,7-8,11-12,15,18H,5-6,9H2/b16-14-
InChIKeyCITRDFTYPMNYOY-PEZBUJJGSA-N
MW240.31 g/mol
LogP3.44
Rot. Bonds1

About (NZ)-N-(3-indol-1-yl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine

(NZ)-N-(3-indol-1-yl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine (PubChem CID 20788489) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is (NZ)-N-(3-indol-1-yl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-(3-indol-1-yl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine
PubChem CID20788489
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name(NZ)-N-(3-indol-1-yl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine
SMILESO/N=C1/C2CCC(C2)C1n1ccc2ccccc21
InChIInChI=1S/C15H16N2O/c18-16-14-11-5-6-12(9-11)15(14)17-8-7-10-3-1-2-4-13(10)17/h1-4,7-8,11-12,15,18H,5-6,9H2/b16-14-
InChIKeyCITRDFTYPMNYOY-PEZBUJJGSA-N
XLogP3.44
TPSA37.52 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 53.44
H-Bond Donors ≤ 51
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

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CID 11781
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1-methyl-N,N-dimethyltryptamine
CID 25927
(2-Indol-1-yl-ethyl)-dimethyl-amine
CID 15893127
[2-(3-Benzyl-indol-1-yl)-ethyl]-dimethyl-amine
CID 20722800
3-(1H-indol-1-yl)-N-methyl-3-phenylpropan-1-amine
CID 44593439
N-[(1,2-dimethylindol-3-yl)methylidene]hydroxylamine
CID 9579933
1-methyl-3-(2-nitro-1-phenylethyl)-1H-indole
CID 4168947
N,N-Diethyl-1H-indole-1-ethanamine
CID 51575
N,N-Dimethyl-1H-indole-1-propylamine
CID 88721
1-Benzylindole
CID 96913

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-(3-indol-1-yl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine?
The IUPAC name of (NZ)-N-(3-indol-1-yl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine (CID 20788489) is (NZ)-N-(3-indol-1-yl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine.
What is the SMILES notation for (NZ)-N-(3-indol-1-yl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine?
The canonical SMILES for (NZ)-N-(3-indol-1-yl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine is O/N=C1/C2CCC(C2)C1n1ccc2ccccc21.
What is the InChIKey of (NZ)-N-(3-indol-1-yl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine?
The InChIKey is CITRDFTYPMNYOY-PEZBUJJGSA-N. The full InChI is InChI=1S/C15H16N2O/c18-16-14-11-5-6-12(9-11)15(14)17-8-7-10-3-1-2-4-13(10)17/h1-4,7-8,11-12,15,18H,5-6,9H2/b16-14-.
What are the key properties of (NZ)-N-(3-indol-1-yl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine?
(NZ)-N-(3-indol-1-yl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine has a molecular weight of 240.31 g/mol, XLogP of 3.44, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-(3-indol-1-yl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine is sourced from PubChem (CID 20788489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).