2-ethoxy-N-[(6-methylpiperidin-2-yl)methyl]aniline

C15H24N2O — CID 54855753

IUPAC2-ethoxy-N-[(6-methylpiperidin-2-yl)methyl]aniline
SMILESCCOc1ccccc1NCC1CCCC(C)N1
InChIInChI=1S/C15H24N2O/c1-3-18-15-10-5-4-9-14(15)16-11-13-8-6-7-12(2)17-13/h4-5,9-10,12-13,16-17H,3,6-8,11H2,1-2H3
InChIKeyVCYZTLJPKHNAEN-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.03
Rot. Bonds5

About 2-ethoxy-N-[(6-methylpiperidin-2-yl)methyl]aniline

2-ethoxy-N-[(6-methylpiperidin-2-yl)methyl]aniline (PubChem CID 54855753) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-ethoxy-N-[(6-methylpiperidin-2-yl)methyl]aniline.

Molecular Properties

Compound Name2-ethoxy-N-[(6-methylpiperidin-2-yl)methyl]aniline
PubChem CID54855753
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-ethoxy-N-[(6-methylpiperidin-2-yl)methyl]aniline
SMILESCCOc1ccccc1NCC1CCCC(C)N1
InChIInChI=1S/C15H24N2O/c1-3-18-15-10-5-4-9-14(15)16-11-13-8-6-7-12(2)17-13/h4-5,9-10,12-13,16-17H,3,6-8,11H2,1-2H3
InChIKeyVCYZTLJPKHNAEN-UHFFFAOYSA-N
XLogP3.03
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-ethoxy-N-[(6-methylpiperidin-2-yl)methyl]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-(2-ethoxyethoxy)-N-[(6-methylpiperidin-2-yl)methyl]aniline
CID 54855650
2-butoxy-N-[(6-methylpiperidin-2-yl)methyl]aniline
CID 54855465
N-[(6-methylpiperidin-2-yl)methyl]-2-propan-2-yloxyaniline
CID 54855757
3-ethoxy-N-[(6-methylpiperidin-2-yl)methyl]aniline
CID 54855539
N-(cyclopropylmethyl)-2-propoxyaniline
CID 43682348
2-ethoxy-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)aniline
CID 102896587
N-(2-butoxyphenyl)-6-methylpiperidine-2-carboxamide
CID 54856149
N-[(5,5-dimethyloxolan-2-yl)methyl]-2-ethoxyaniline
CID 116521071
N-(piperidin-2-ylmethyl)-2-(2,2,2-trifluoroethoxy)aniline
CID 106633280
N-(piperidin-3-ylmethyl)-2-propoxyaniline
CID 80553333
N-(2-ethoxyphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 24703621
N-(2-ethoxyphenyl)-6-methylpiperidine-3-carboxamide
CID 24711526

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[(6-methylpiperidin-2-yl)methyl]aniline?
The IUPAC name of 2-ethoxy-N-[(6-methylpiperidin-2-yl)methyl]aniline (CID 54855753) is 2-ethoxy-N-[(6-methylpiperidin-2-yl)methyl]aniline.
What is the SMILES notation for 2-ethoxy-N-[(6-methylpiperidin-2-yl)methyl]aniline?
The canonical SMILES for 2-ethoxy-N-[(6-methylpiperidin-2-yl)methyl]aniline is CCOc1ccccc1NCC1CCCC(C)N1.
What is the InChIKey of 2-ethoxy-N-[(6-methylpiperidin-2-yl)methyl]aniline?
The InChIKey is VCYZTLJPKHNAEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-3-18-15-10-5-4-9-14(15)16-11-13-8-6-7-12(2)17-13/h4-5,9-10,12-13,16-17H,3,6-8,11H2,1-2H3.
What are the key properties of 2-ethoxy-N-[(6-methylpiperidin-2-yl)methyl]aniline?
2-ethoxy-N-[(6-methylpiperidin-2-yl)methyl]aniline has a molecular weight of 248.37 g/mol, XLogP of 3.03, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[(6-methylpiperidin-2-yl)methyl]aniline is sourced from PubChem (CID 54855753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).