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

C19H18N2O — CID 9014704

IUPACN-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]-2-methylaniline
SMILESCOc1ccc2ccccc2c1/C=N\Nc1ccccc1C
InChIInChI=1S/C19H18N2O/c1-14-7-3-6-10-18(14)21-20-13-17-16-9-5-4-8-15(16)11-12-19(17)22-2/h3-13,21H,1-2H3/b20-13-
InChIKeyQDQJKLKYHISJTK-MOSHPQCFSA-N
MW290.37 g/mol
LogP4.60
Rot. Bonds4

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

N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]-2-methylaniline (PubChem CID 9014704) has the molecular formula C19H18N2O and a molecular weight of 290.37 g/mol. Its IUPAC name is N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]-2-methylaniline.

Molecular Properties

Compound NameN-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]-2-methylaniline
PubChem CID9014704
Molecular FormulaC19H18N2O
Molecular Weight290.37 g/mol
Exact Mass290.14
IUPAC NameN-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]-2-methylaniline
SMILESCOc1ccc2ccccc2c1/C=N\Nc1ccccc1C
InChIInChI=1S/C19H18N2O/c1-14-7-3-6-10-18(14)21-20-13-17-16-9-5-4-8-15(16)11-12-19(17)22-2/h3-13,21H,1-2H3/b20-13-
InChIKeyQDQJKLKYHISJTK-MOSHPQCFSA-N
XLogP4.60
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 54.60
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-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]naphthalen-2-amine
CID 6024957
7-chloro-N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]quinolin-4-amine
CID 6181870
ethyl N-[(E)-(2-methoxynaphthalen-1-yl)methylideneamino]carbamate
CID 6898993
1-(3,4-dimethoxyphenyl)-N-[(E)-(2-methoxynaphthalen-1-yl)methylideneamino]methanamine
CID 133169001
5-bromo-4-[2-[(2-methoxynaphthalen-1-yl)methylidene]hydrazinyl]-1H-pyridazin-6-one
CID 7200282
N-[(2-methoxynaphthalen-1-yl)methylidene]hydroxylamine
CID 708036
N-(2,3-dimethylphenyl)-1-(2-methoxynaphthalen-1-yl)methanimine
CID 126214700
N-[(Z)-(3-ethoxy-4-methoxyphenyl)methylideneamino]-2-methylaniline
CID 9014773
5-[2-[(2-methoxynaphthalen-1-yl)methylidene]hydrazinyl]-6-methyl-2H-1,2,4-triazin-3-one
CID 2791357
4-N-(2,4-dimethylphenyl)-2-N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]-6-N-phenyl-1,3,5-triazine-2,4,6-triamine
CID 171978873
4-ethyl-2-[(2Z)-2-[(2-methoxynaphthalen-1-yl)methylidene]hydrazinyl]-1H-pyrimidin-6-one
CID 136787623
1-[(2-ethoxynaphthalen-1-yl)methylideneamino]-3-(2-methylphenyl)urea
CID 926829

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]-2-methylaniline?
The IUPAC name of N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]-2-methylaniline (CID 9014704) is N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]-2-methylaniline.
What is the SMILES notation for N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]-2-methylaniline?
The canonical SMILES for N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]-2-methylaniline is COc1ccc2ccccc2c1/C=N\Nc1ccccc1C.
What is the InChIKey of N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]-2-methylaniline?
The InChIKey is QDQJKLKYHISJTK-MOSHPQCFSA-N. The full InChI is InChI=1S/C19H18N2O/c1-14-7-3-6-10-18(14)21-20-13-17-16-9-5-4-8-15(16)11-12-19(17)22-2/h3-13,21H,1-2H3/b20-13-.
What are the key properties of N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]-2-methylaniline?
N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]-2-methylaniline has a molecular weight of 290.37 g/mol, XLogP of 4.60, 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]-2-methylaniline is sourced from PubChem (CID 9014704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).