2-[2-[(2-methoxyethylamino)methyl]-N,4-dimethylanilino]ethanol

C14H24N2O2 — CID 114055007

IUPAC2-[2-[(2-methoxyethylamino)methyl]-N,4-dimethylanilino]ethanol
SMILESCOCCNCc1cc(C)ccc1N(C)CCO
InChIInChI=1S/C14H24N2O2/c1-12-4-5-14(16(2)7-8-17)13(10-12)11-15-6-9-18-3/h4-5,10,15,17H,6-9,11H2,1-3H3
InChIKeyUHPYWDFPYOINCW-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.16
Rot. Bonds8

About 2-[2-[(2-methoxyethylamino)methyl]-N,4-dimethylanilino]ethanol

2-[2-[(2-methoxyethylamino)methyl]-N,4-dimethylanilino]ethanol (PubChem CID 114055007) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 2-[2-[(2-methoxyethylamino)methyl]-N,4-dimethylanilino]ethanol.

Molecular Properties

Compound Name2-[2-[(2-methoxyethylamino)methyl]-N,4-dimethylanilino]ethanol
PubChem CID114055007
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name2-[2-[(2-methoxyethylamino)methyl]-N,4-dimethylanilino]ethanol
SMILESCOCCNCc1cc(C)ccc1N(C)CCO
InChIInChI=1S/C14H24N2O2/c1-12-4-5-14(16(2)7-8-17)13(10-12)11-15-6-9-18-3/h4-5,10,15,17H,6-9,11H2,1-3H3
InChIKeyUHPYWDFPYOINCW-UHFFFAOYSA-N
XLogP1.16
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[4-[(2-methoxyethylamino)methyl]-N,2-dimethylanilino]ethanol
CID 63058822
N-butyl-4-chloro-2-[(2-methoxyethylamino)methyl]-N-methylaniline
CID 114847405
N'-[2-[(2-methoxyethylamino)methyl]phenyl]-N,N,N'-trimethylpropane-1,3-diamine
CID 63699734
4-chloro-N-(2-ethoxyethyl)-2-[(2-methoxyethylamino)methyl]-N-methylaniline
CID 114852817
2-[4-chloro-N-methyl-2-(propylaminomethyl)anilino]ethanol
CID 114848634
2-[3-chloro-2-[(2-methoxyethylamino)methyl]-N-methylanilino]ethanol
CID 63059522
1-[4-fluoro-2-[(2-methoxyethylamino)methyl]-N-methylanilino]propan-2-ol
CID 55147418
N-(2-methoxyethyl)-4-[(2-methoxyethylamino)methyl]-N,2-dimethylaniline
CID 63060791
2-[4-chloro-2-[(2-methoxyethylamino)methyl]-N-methylanilino]acetamide
CID 114848156
4-chloro-N-(2,2-dimethylpropyl)-2-[(2-methoxyethylamino)methyl]-N-methylaniline
CID 114850376
N-(2,2-dimethylpropyl)-4-fluoro-2-[(2-methoxyethylamino)methyl]-N-methylaniline
CID 63071895
2-[N-butyl-5-chloro-2-[(2-methoxyethylamino)methyl]anilino]ethanol
CID 114849250

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(2-methoxyethylamino)methyl]-N,4-dimethylanilino]ethanol?
The IUPAC name of 2-[2-[(2-methoxyethylamino)methyl]-N,4-dimethylanilino]ethanol (CID 114055007) is 2-[2-[(2-methoxyethylamino)methyl]-N,4-dimethylanilino]ethanol.
What is the SMILES notation for 2-[2-[(2-methoxyethylamino)methyl]-N,4-dimethylanilino]ethanol?
The canonical SMILES for 2-[2-[(2-methoxyethylamino)methyl]-N,4-dimethylanilino]ethanol is COCCNCc1cc(C)ccc1N(C)CCO.
What is the InChIKey of 2-[2-[(2-methoxyethylamino)methyl]-N,4-dimethylanilino]ethanol?
The InChIKey is UHPYWDFPYOINCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-12-4-5-14(16(2)7-8-17)13(10-12)11-15-6-9-18-3/h4-5,10,15,17H,6-9,11H2,1-3H3.
What are the key properties of 2-[2-[(2-methoxyethylamino)methyl]-N,4-dimethylanilino]ethanol?
2-[2-[(2-methoxyethylamino)methyl]-N,4-dimethylanilino]ethanol has a molecular weight of 252.36 g/mol, XLogP of 1.16, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(2-methoxyethylamino)methyl]-N,4-dimethylanilino]ethanol is sourced from PubChem (CID 114055007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).