N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]naphthalen-2-amine

C22H18N2O — CID 6024957

IUPACN-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]naphthalen-2-amine
SMILESCOc1ccc2ccccc2c1/C=N\Nc1ccc2ccccc2c1
InChIInChI=1S/C22H18N2O/c1-25-22-13-11-17-7-4-5-9-20(17)21(22)15-23-24-19-12-10-16-6-2-3-8-18(16)14-19/h2-15,24H,1H3/b23-15-
InChIKeyBUKDTZVTJPKZOY-HAHDFKILSA-N
MW326.40 g/mol
LogP5.45
Rot. Bonds4

About N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]naphthalen-2-amine

N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]naphthalen-2-amine (PubChem CID 6024957) has the molecular formula C22H18N2O and a molecular weight of 326.40 g/mol. Its IUPAC name is N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]naphthalen-2-amine.

Molecular Properties

Compound NameN-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]naphthalen-2-amine
PubChem CID6024957
Molecular FormulaC22H18N2O
Molecular Weight326.40 g/mol
Exact Mass326.14
IUPAC NameN-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]naphthalen-2-amine
SMILESCOc1ccc2ccccc2c1/C=N\Nc1ccc2ccccc2c1
InChIInChI=1S/C22H18N2O/c1-25-22-13-11-17-7-4-5-9-20(17)21(22)15-23-24-19-12-10-16-6-2-3-8-18(16)14-19/h2-15,24H,1H3/b23-15-
InChIKeyBUKDTZVTJPKZOY-HAHDFKILSA-N
XLogP5.45
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.40
LogP ≤ 55.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(E)-(2,7-dimethoxynaphthalen-1-yl)methylideneamino]aniline
CID 126015225
N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]-2-methylaniline
CID 9014704
N-[(2-methoxynaphthalen-1-yl)methylidene]hydroxylamine
CID 708036
1-(3,4-dimethoxyphenyl)-N-[(E)-(2-methoxynaphthalen-1-yl)methylideneamino]methanamine
CID 133169001
4-ethyl-2-[(2Z)-2-[(2-methoxynaphthalen-1-yl)methylidene]hydrazinyl]-1H-pyrimidin-6-one
CID 136787623
N-[(E)-(2-methoxynaphthalen-1-yl)methylideneamino]-2-(3-methoxyphenoxy)acetamide
CID 19208685
ethyl N-[(E)-(2-methoxynaphthalen-1-yl)methylideneamino]carbamate
CID 6898993
(E)-1-(2-methoxynaphthalen-1-yl)-N-trimethylsilylmethanimine
CID 15419490
7-chloro-N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]quinolin-4-amine
CID 6181870
2-[(2Z)-2-[(2-methoxynaphthalen-1-yl)methylidene]hydrazinyl]-4-phenyl-1H-pyrimidin-6-one
CID 136920869
5-[2-[(2-methoxynaphthalen-1-yl)methylidene]hydrazinyl]-6-methyl-2H-1,2,4-triazin-3-one
CID 2791357
1-[(2-methoxynaphthalen-1-yl)methylideneamino]-3-(3-methylphenyl)thiourea
CID 693364

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]naphthalen-2-amine?
The IUPAC name of N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]naphthalen-2-amine (CID 6024957) is N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]naphthalen-2-amine.
What is the SMILES notation for N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]naphthalen-2-amine?
The canonical SMILES for N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]naphthalen-2-amine is COc1ccc2ccccc2c1/C=N\Nc1ccc2ccccc2c1.
What is the InChIKey of N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]naphthalen-2-amine?
The InChIKey is BUKDTZVTJPKZOY-HAHDFKILSA-N. The full InChI is InChI=1S/C22H18N2O/c1-25-22-13-11-17-7-4-5-9-20(17)21(22)15-23-24-19-12-10-16-6-2-3-8-18(16)14-19/h2-15,24H,1H3/b23-15-.
What are the key properties of N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]naphthalen-2-amine?
N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]naphthalen-2-amine has a molecular weight of 326.40 g/mol, XLogP of 5.45, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]naphthalen-2-amine is sourced from PubChem (CID 6024957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).