2-methoxy-5-methyl-N-[1-(oxolan-3-yl)ethyl]aniline

C14H21NO2 — CID 113354819

IUPAC2-methoxy-5-methyl-N-[1-(oxolan-3-yl)ethyl]aniline
SMILESCOc1ccc(C)cc1NC(C)C1CCOC1
InChIInChI=1S/C14H21NO2/c1-10-4-5-14(16-3)13(8-10)15-11(2)12-6-7-17-9-12/h4-5,8,11-12,15H,6-7,9H2,1-3H3
InChIKeyRRDVHJZMYUVRJH-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.84
Rot. Bonds4

About 2-methoxy-5-methyl-N-[1-(oxolan-3-yl)ethyl]aniline

2-methoxy-5-methyl-N-[1-(oxolan-3-yl)ethyl]aniline (PubChem CID 113354819) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-methoxy-5-methyl-N-[1-(oxolan-3-yl)ethyl]aniline.

Molecular Properties

Compound Name2-methoxy-5-methyl-N-[1-(oxolan-3-yl)ethyl]aniline
PubChem CID113354819
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-methoxy-5-methyl-N-[1-(oxolan-3-yl)ethyl]aniline
SMILESCOc1ccc(C)cc1NC(C)C1CCOC1
InChIInChI=1S/C14H21NO2/c1-10-4-5-14(16-3)13(8-10)15-11(2)12-6-7-17-9-12/h4-5,8,11-12,15H,6-7,9H2,1-3H3
InChIKeyRRDVHJZMYUVRJH-UHFFFAOYSA-N
XLogP2.84
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methoxy-5-methyl-N-[1-(oxolan-3-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

2,4-dimethyl-N-[1-(oxolan-3-yl)ethyl]aniline
CID 115925815
4-methoxy-3-[1-(oxolan-3-yl)ethylamino]benzamide
CID 115928742
4-fluoro-2-methoxy-N-[1-(oxolan-3-yl)ethyl]aniline
CID 115916579
2-ethoxy-4-methyl-N-[1-(oxolan-3-yl)ethyl]aniline
CID 115929063
N-[(2-methoxy-5-methylphenyl)methyl]-1-(oxolan-3-yl)ethanamine
CID 115655223
N-(2-methoxy-5-methylphenyl)oxolan-3-amine
CID 63331725
N-[1-(1-ethylpiperidin-4-yl)ethyl]-2-methoxy-5-methylaniline
CID 43307758
4-fluoro-3-methoxy-N-[1-(oxolan-3-yl)ethyl]aniline
CID 114838689
5-chloro-N-[1-(oxolan-3-yl)ethyl]-2-propoxyaniline
CID 115929019
[(2-methoxy-4-methylphenyl)-(oxolan-3-yl)methyl]hydrazine
CID 106793716
N-[1-(2-bicyclo[2.2.1]hept-5-enyl)ethyl]-2-methoxy-5-methylaniline
CID 43761121
N-[(3-fluoro-4-methoxyphenyl)methyl]-1-(oxolan-3-yl)ethanamine
CID 113243362

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-methyl-N-[1-(oxolan-3-yl)ethyl]aniline?
The IUPAC name of 2-methoxy-5-methyl-N-[1-(oxolan-3-yl)ethyl]aniline (CID 113354819) is 2-methoxy-5-methyl-N-[1-(oxolan-3-yl)ethyl]aniline.
What is the SMILES notation for 2-methoxy-5-methyl-N-[1-(oxolan-3-yl)ethyl]aniline?
The canonical SMILES for 2-methoxy-5-methyl-N-[1-(oxolan-3-yl)ethyl]aniline is COc1ccc(C)cc1NC(C)C1CCOC1.
What is the InChIKey of 2-methoxy-5-methyl-N-[1-(oxolan-3-yl)ethyl]aniline?
The InChIKey is RRDVHJZMYUVRJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-10-4-5-14(16-3)13(8-10)15-11(2)12-6-7-17-9-12/h4-5,8,11-12,15H,6-7,9H2,1-3H3.
What are the key properties of 2-methoxy-5-methyl-N-[1-(oxolan-3-yl)ethyl]aniline?
2-methoxy-5-methyl-N-[1-(oxolan-3-yl)ethyl]aniline has a molecular weight of 235.33 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-methyl-N-[1-(oxolan-3-yl)ethyl]aniline is sourced from PubChem (CID 113354819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).