2-methoxy-5-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]aniline

C15H25N3O — CID 79019437

IUPAC2-methoxy-5-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]aniline
SMILESCOc1ccc(C)cc1NCCN1CCN(C)CC1
InChIInChI=1S/C15H25N3O/c1-13-4-5-15(19-3)14(12-13)16-6-7-18-10-8-17(2)9-11-18/h4-5,12,16H,6-11H2,1-3H3
InChIKeySFGLWDOCYMBHII-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.66
Rot. Bonds5

About 2-methoxy-5-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]aniline

2-methoxy-5-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]aniline (PubChem CID 79019437) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-methoxy-5-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]aniline.

Molecular Properties

Compound Name2-methoxy-5-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]aniline
PubChem CID79019437
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name2-methoxy-5-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]aniline
SMILESCOc1ccc(C)cc1NCCN1CCN(C)CC1
InChIInChI=1S/C15H25N3O/c1-13-4-5-15(19-3)14(12-13)16-6-7-18-10-8-17(2)9-11-18/h4-5,12,16H,6-11H2,1-3H3
InChIKeySFGLWDOCYMBHII-UHFFFAOYSA-N
XLogP1.66
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methoxy-5-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]aniline 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

3-fluoro-4-methoxy-N-[2-(4-methylpiperazin-1-yl)ethyl]aniline
CID 82889797
2-methoxy-5-methyl-N-[3-(4-methylpiperazin-1-yl)propyl]benzenesulfonamide
CID 8824169
3-(2-methoxy-5-methylanilino)-N-(2-morpholin-4-ylethyl)propanamide
CID 109016626
N-(2-fluoroethyl)-2-methoxy-5-methylaniline
CID 80699786
ethane;methanol;methyl 4-methoxy-3-[2-(4-methylpiperazin-1-yl)ethylamino]benzoate;prop-1-yn-1-ol
CID 144638768
ethane;1-[(2-methoxy-5-methylphenyl)methyl]-4-methylpiperazine
CID 144540102
4-N-(2-methoxy-5-methylphenyl)-6-N-(2-morpholin-4-ylethyl)pyrimidine-4,5,6-triamine
CID 22541986
2-(2-methoxy-5-methylanilino)ethane-1,1-diol
CID 154118802
2-fluoro-5-methyl-N-(2-pyrrolidin-1-ylethyl)aniline
CID 107911386
2,5-dimethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]aniline
CID 54807933
2-methoxy-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]aniline
CID 22458185
1-(3,4-dihydro-2H-quinolin-1-yl)-3-(2-methoxy-5-methylanilino)propan-1-one
CID 47877423

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]aniline?
The IUPAC name of 2-methoxy-5-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]aniline (CID 79019437) is 2-methoxy-5-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]aniline.
What is the SMILES notation for 2-methoxy-5-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]aniline?
The canonical SMILES for 2-methoxy-5-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]aniline is COc1ccc(C)cc1NCCN1CCN(C)CC1.
What is the InChIKey of 2-methoxy-5-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]aniline?
The InChIKey is SFGLWDOCYMBHII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-13-4-5-15(19-3)14(12-13)16-6-7-18-10-8-17(2)9-11-18/h4-5,12,16H,6-11H2,1-3H3.
What are the key properties of 2-methoxy-5-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]aniline?
2-methoxy-5-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]aniline has a molecular weight of 263.38 g/mol, XLogP of 1.66, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]aniline is sourced from PubChem (CID 79019437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).