(NZ)-N-(4,4-dimethyl-2,3-dihydronaphthalen-1-ylidene)hydroxylamine

C12H15NO — CID 62968024

IUPAC(NZ)-N-(4,4-dimethyl-2,3-dihydronaphthalen-1-ylidene)hydroxylamine
SMILESCC1(C)CC/C(=N/O)c2ccccc21
InChIInChI=1S/C12H15NO/c1-12(2)8-7-11(13-14)9-5-3-4-6-10(9)12/h3-6,14H,7-8H2,1-2H3/b13-11-
InChIKeyBGFOUGWGRFOSQN-QBFSEMIESA-N
MW189.26 g/mol
LogP2.94
Rot. Bonds

About (NZ)-N-(4,4-dimethyl-2,3-dihydronaphthalen-1-ylidene)hydroxylamine

(NZ)-N-(4,4-dimethyl-2,3-dihydronaphthalen-1-ylidene)hydroxylamine (PubChem CID 62968024) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is (NZ)-N-(4,4-dimethyl-2,3-dihydronaphthalen-1-ylidene)hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-(4,4-dimethyl-2,3-dihydronaphthalen-1-ylidene)hydroxylamine
PubChem CID62968024
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC Name(NZ)-N-(4,4-dimethyl-2,3-dihydronaphthalen-1-ylidene)hydroxylamine
SMILESCC1(C)CC/C(=N/O)c2ccccc21
InChIInChI=1S/C12H15NO/c1-12(2)8-7-11(13-14)9-5-3-4-6-10(9)12/h3-6,14H,7-8H2,1-2H3/b13-11-
InChIKeyBGFOUGWGRFOSQN-QBFSEMIESA-N
XLogP2.94
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.94
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-(4,4-dimethyl-2,3-dihydronaphthalen-1-ylidene)hydroxylamine?
The IUPAC name of (NZ)-N-(4,4-dimethyl-2,3-dihydronaphthalen-1-ylidene)hydroxylamine (CID 62968024) is (NZ)-N-(4,4-dimethyl-2,3-dihydronaphthalen-1-ylidene)hydroxylamine.
What is the SMILES notation for (NZ)-N-(4,4-dimethyl-2,3-dihydronaphthalen-1-ylidene)hydroxylamine?
The canonical SMILES for (NZ)-N-(4,4-dimethyl-2,3-dihydronaphthalen-1-ylidene)hydroxylamine is CC1(C)CC/C(=N/O)c2ccccc21.
What is the InChIKey of (NZ)-N-(4,4-dimethyl-2,3-dihydronaphthalen-1-ylidene)hydroxylamine?
The InChIKey is BGFOUGWGRFOSQN-QBFSEMIESA-N. The full InChI is InChI=1S/C12H15NO/c1-12(2)8-7-11(13-14)9-5-3-4-6-10(9)12/h3-6,14H,7-8H2,1-2H3/b13-11-.
What are the key properties of (NZ)-N-(4,4-dimethyl-2,3-dihydronaphthalen-1-ylidene)hydroxylamine?
(NZ)-N-(4,4-dimethyl-2,3-dihydronaphthalen-1-ylidene)hydroxylamine has a molecular weight of 189.26 g/mol, XLogP of 2.94, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-(4,4-dimethyl-2,3-dihydronaphthalen-1-ylidene)hydroxylamine is sourced from PubChem (CID 62968024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).