(E)-1-(6-methoxynaphthalen-2-yl)-N-(4-methylpiperazin-1-yl)ethanimine

C18H23N3O — CID 43005008

IUPAC(E)-1-(6-methoxynaphthalen-2-yl)-N-(4-methylpiperazin-1-yl)ethanimine
SMILESCOc1ccc2cc(/C(C)=N/N3CCN(C)CC3)ccc2c1
InChIInChI=1S/C18H23N3O/c1-14(19-21-10-8-20(2)9-11-21)15-4-5-17-13-18(22-3)7-6-16(17)12-15/h4-7,12-13H,8-11H2,1-3H3/b19-14+
InChIKeyTVDSFDNGBQGVCU-XMHGGMMESA-N
MW297.40 g/mol
LogP2.82
Rot. Bonds3

About (E)-1-(6-methoxynaphthalen-2-yl)-N-(4-methylpiperazin-1-yl)ethanimine

(E)-1-(6-methoxynaphthalen-2-yl)-N-(4-methylpiperazin-1-yl)ethanimine (PubChem CID 43005008) has the molecular formula C18H23N3O and a molecular weight of 297.40 g/mol. Its IUPAC name is (E)-1-(6-methoxynaphthalen-2-yl)-N-(4-methylpiperazin-1-yl)ethanimine.

Molecular Properties

Compound Name(E)-1-(6-methoxynaphthalen-2-yl)-N-(4-methylpiperazin-1-yl)ethanimine
PubChem CID43005008
Molecular FormulaC18H23N3O
Molecular Weight297.40 g/mol
Exact Mass297.18
IUPAC Name(E)-1-(6-methoxynaphthalen-2-yl)-N-(4-methylpiperazin-1-yl)ethanimine
SMILESCOc1ccc2cc(/C(C)=N/N3CCN(C)CC3)ccc2c1
InChIInChI=1S/C18H23N3O/c1-14(19-21-10-8-20(2)9-11-21)15-4-5-17-13-18(22-3)7-6-16(17)12-15/h4-7,12-13H,8-11H2,1-3H3/b19-14+
InChIKeyTVDSFDNGBQGVCU-XMHGGMMESA-N
XLogP2.82
TPSA28.07 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (E)-1-(6-methoxynaphthalen-2-yl)-N-(4-methylpiperazin-1-yl)ethanimine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E)-1-(3,4-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)ethanimine
CID 43019174
(Z)-1-(4-methoxyphenyl)-N-(4-phenylpiperazin-1-yl)ethanimine
CID 5398172
(E)-1-(6-methoxynaphthalen-2-yl)-N-(2-pyrrolidin-1-ylethoxy)ethanimine;hydrochloride
CID 24983335
1-(4-methoxyphenyl)-N-[4-(2-methoxyphenyl)piperazin-1-yl]ethanimine
CID 761172
(Z)-N-(4-benzylpiperazin-1-yl)-1-(4-methoxyphenyl)ethanimine
CID 5413986
2-(4-methoxyphenyl)-5-methyl-4-[(E)-C-methyl-N-(4-methylpiperazin-1-yl)carbonimidoyl]-1H-pyrazol-3-one
CID 135727540
6-hydroxy-1-(4-methoxyphenyl)-5-[(E)-C-methyl-N-(4-methylpiperazin-1-yl)carbonimidoyl]pyrimidine-2,4-dione
CID 135822372
(E)-1-(3,4-dimethoxyphenyl)-N-morpholin-4-ylethanimine
CID 75361321
2-[1-(6-methoxynaphthalen-2-yl)ethylideneamino]oxy-N,N-dimethylethanamine;hydrochloride
CID 74379261
(Z)-1-(2,4-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)methanimine
CID 5413886
4-(6-methoxynaphthalene-2-carbonyl)benzoic acid
CID 70129561
3-(6-methoxynaphthalen-2-yl)but-3-en-2-one
CID 142826310

Frequently Asked Questions

What is the IUPAC name of (E)-1-(6-methoxynaphthalen-2-yl)-N-(4-methylpiperazin-1-yl)ethanimine?
The IUPAC name of (E)-1-(6-methoxynaphthalen-2-yl)-N-(4-methylpiperazin-1-yl)ethanimine (CID 43005008) is (E)-1-(6-methoxynaphthalen-2-yl)-N-(4-methylpiperazin-1-yl)ethanimine.
What is the SMILES notation for (E)-1-(6-methoxynaphthalen-2-yl)-N-(4-methylpiperazin-1-yl)ethanimine?
The canonical SMILES for (E)-1-(6-methoxynaphthalen-2-yl)-N-(4-methylpiperazin-1-yl)ethanimine is COc1ccc2cc(/C(C)=N/N3CCN(C)CC3)ccc2c1.
What is the InChIKey of (E)-1-(6-methoxynaphthalen-2-yl)-N-(4-methylpiperazin-1-yl)ethanimine?
The InChIKey is TVDSFDNGBQGVCU-XMHGGMMESA-N. The full InChI is InChI=1S/C18H23N3O/c1-14(19-21-10-8-20(2)9-11-21)15-4-5-17-13-18(22-3)7-6-16(17)12-15/h4-7,12-13H,8-11H2,1-3H3/b19-14+.
What are the key properties of (E)-1-(6-methoxynaphthalen-2-yl)-N-(4-methylpiperazin-1-yl)ethanimine?
(E)-1-(6-methoxynaphthalen-2-yl)-N-(4-methylpiperazin-1-yl)ethanimine has a molecular weight of 297.40 g/mol, XLogP of 2.82, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(6-methoxynaphthalen-2-yl)-N-(4-methylpiperazin-1-yl)ethanimine is sourced from PubChem (CID 43005008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).