(NZ)-N-(2,3-dihydroinden-1-ylidene)hydroxylamine

C9H9NO — CID 5383710

IUPAC(NZ)-N-(2,3-dihydroinden-1-ylidene)hydroxylamine
SMILESO/N=C1/CCc2ccccc21
InChIInChI=1S/C9H9NO/c11-10-9-6-5-7-3-1-2-4-8(7)9/h1-4,11H,5-6H2/b10-9-
InChIKeyATEGUFMEFAGONB-KTKRTIGZSA-N
MW147.18 g/mol
LogP1.81
Rot. Bonds

About (NZ)-N-(2,3-dihydroinden-1-ylidene)hydroxylamine

(NZ)-N-(2,3-dihydroinden-1-ylidene)hydroxylamine (PubChem CID 5383710) has the molecular formula C9H9NO and a molecular weight of 147.18 g/mol. Its IUPAC name is (NZ)-N-(2,3-dihydroinden-1-ylidene)hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-(2,3-dihydroinden-1-ylidene)hydroxylamine
PubChem CID5383710
Molecular FormulaC9H9NO
Molecular Weight147.18 g/mol
Exact Mass147.07
IUPAC Name(NZ)-N-(2,3-dihydroinden-1-ylidene)hydroxylamine
SMILESO/N=C1/CCc2ccccc21
InChIInChI=1S/C9H9NO/c11-10-9-6-5-7-3-1-2-4-8(7)9/h1-4,11H,5-6H2/b10-9-
InChIKeyATEGUFMEFAGONB-KTKRTIGZSA-N
XLogP1.81
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.18
LogP ≤ 51.81
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

Acetophenone oxime
CID 5464950
Acetophenonoxime
CID 69185
Fluorenone oxime
CID 16543
Ethanone, 1,2-diphenyl-, oxime
CID 5355453
6,7,8,9-Tetrahydro-benzocyclohepten-5-one oxime
CID 5381210
4'-Fluoroacetophenone oxime
CID 5382861
1,2,3,4-Tetrahydronaphthalen-1-one oxime
CID 5483123
(NE)-N-(5-chloro-2,3-dihydroinden-1-ylidene)hydroxylamine
CID 5858529
Phenylacetone ketoxime
CID 5911834
3-Methyl-4-phenyl-3-buten-2-one oxime
CID 6916168
1-Phenyl-1-ethanone oxime
CID 5324612
1-(4-Fluorophenyl)ethanone oxime
CID 9497

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-(2,3-dihydroinden-1-ylidene)hydroxylamine?
The IUPAC name of (NZ)-N-(2,3-dihydroinden-1-ylidene)hydroxylamine (CID 5383710) is (NZ)-N-(2,3-dihydroinden-1-ylidene)hydroxylamine.
What is the SMILES notation for (NZ)-N-(2,3-dihydroinden-1-ylidene)hydroxylamine?
The canonical SMILES for (NZ)-N-(2,3-dihydroinden-1-ylidene)hydroxylamine is O/N=C1/CCc2ccccc21.
What is the InChIKey of (NZ)-N-(2,3-dihydroinden-1-ylidene)hydroxylamine?
The InChIKey is ATEGUFMEFAGONB-KTKRTIGZSA-N. The full InChI is InChI=1S/C9H9NO/c11-10-9-6-5-7-3-1-2-4-8(7)9/h1-4,11H,5-6H2/b10-9-.
What are the key properties of (NZ)-N-(2,3-dihydroinden-1-ylidene)hydroxylamine?
(NZ)-N-(2,3-dihydroinden-1-ylidene)hydroxylamine has a molecular weight of 147.18 g/mol, XLogP of 1.81, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-(2,3-dihydroinden-1-ylidene)hydroxylamine is sourced from PubChem (CID 5383710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).