N-methyl-N-oxidonaphthalen-2-amine

C11H10NO- — CID 163543073

IUPACN-methyl-N-oxidonaphthalen-2-amine
SMILESCN([O-])c1ccc2ccccc2c1
InChIInChI=1S/C11H10NO/c1-12(13)11-7-6-9-4-2-3-5-10(9)8-11/h2-8H,1H3/q-1
InChIKeyPXYKABCKSKCKRV-UHFFFAOYSA-N
MW172.21 g/mol
LogP2.77
Rot. Bonds1

About N-methyl-N-oxidonaphthalen-2-amine

N-methyl-N-oxidonaphthalen-2-amine (PubChem CID 163543073) has the molecular formula C11H10NO- and a molecular weight of 172.21 g/mol. Its IUPAC name is N-methyl-N-oxidonaphthalen-2-amine.

Molecular Properties

Compound NameN-methyl-N-oxidonaphthalen-2-amine
PubChem CID163543073
Molecular FormulaC11H10NO-
Molecular Weight172.21 g/mol
Exact Mass172.08
IUPAC NameN-methyl-N-oxidonaphthalen-2-amine
SMILESCN([O-])c1ccc2ccccc2c1
InChIInChI=1S/C11H10NO/c1-12(13)11-7-6-9-4-2-3-5-10(9)8-11/h2-8H,1H3/q-1
InChIKeyPXYKABCKSKCKRV-UHFFFAOYSA-N
XLogP2.77
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.21
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(3,4-dimethylphenyl)-N-methylnaphthalen-2-amine
CID 163968622
N-(3,5-dimethylphenyl)-N-methylnaphthalen-2-amine
CID 70891373
[methyl(naphthalen-2-yl)amino] sulfite
CID 174392353
4-dinaphthalen-2-ylphosphanyl-N,N-dimethylaniline
CID 141200555
ethane;N-methyl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine
CID 143983755
N,N-dimethyl-4-naphthalen-2-ylaniline
CID 46854357
N-methyl-N-naphthalen-2-ylnaphthalene-2-carboxamide
CID 26904267
N-methyl-N-(2,3,5,6-tetramethylphenyl)naphthalen-2-amine
CID 163608925
N-[(3-aminocyclobutyl)methyl]-N-methylnaphthalen-2-amine
CID 115214015
N,1-dimethyl-N-naphthalen-2-ylnaphthalen-2-amine
CID 143268733
N-methyl-N-naphthalen-2-ylquinolin-2-amine
CID 70891325
N-[3,4-bis(ethenyl)phenyl]-N-methylnaphthalen-2-amine
CID 143975290

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-oxidonaphthalen-2-amine?
The IUPAC name of N-methyl-N-oxidonaphthalen-2-amine (CID 163543073) is N-methyl-N-oxidonaphthalen-2-amine.
What is the SMILES notation for N-methyl-N-oxidonaphthalen-2-amine?
The canonical SMILES for N-methyl-N-oxidonaphthalen-2-amine is CN([O-])c1ccc2ccccc2c1.
What is the InChIKey of N-methyl-N-oxidonaphthalen-2-amine?
The InChIKey is PXYKABCKSKCKRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10NO/c1-12(13)11-7-6-9-4-2-3-5-10(9)8-11/h2-8H,1H3/q-1.
What are the key properties of N-methyl-N-oxidonaphthalen-2-amine?
N-methyl-N-oxidonaphthalen-2-amine has a molecular weight of 172.21 g/mol, XLogP of 2.77, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-oxidonaphthalen-2-amine is sourced from PubChem (CID 163543073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).