2-(4-ethylphenyl)-N-(morpholin-2-ylmethyl)ethanamine

C15H24N2O — CID 115237698

IUPAC2-(4-ethylphenyl)-N-(morpholin-2-ylmethyl)ethanamine
SMILESCCc1ccc(CCNCC2CNCCO2)cc1
InChIInChI=1S/C15H24N2O/c1-2-13-3-5-14(6-4-13)7-8-16-11-15-12-17-9-10-18-15/h3-6,15-17H,2,7-12H2,1H3
InChIKeyMXBZLGJFJLBIBO-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.37
Rot. Bonds6

About 2-(4-ethylphenyl)-N-(morpholin-2-ylmethyl)ethanamine

2-(4-ethylphenyl)-N-(morpholin-2-ylmethyl)ethanamine (PubChem CID 115237698) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-(4-ethylphenyl)-N-(morpholin-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-(4-ethylphenyl)-N-(morpholin-2-ylmethyl)ethanamine
PubChem CID115237698
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-(4-ethylphenyl)-N-(morpholin-2-ylmethyl)ethanamine
SMILESCCc1ccc(CCNCC2CNCCO2)cc1
InChIInChI=1S/C15H24N2O/c1-2-13-3-5-14(6-4-13)7-8-16-11-15-12-17-9-10-18-15/h3-6,15-17H,2,7-12H2,1H3
InChIKeyMXBZLGJFJLBIBO-UHFFFAOYSA-N
XLogP1.37
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(3-fluoro-4-methoxyphenyl)-N-(morpholin-2-ylmethyl)ethanamine
CID 115237709
N-[(4-methoxyphenyl)methyl]-1-morpholin-2-ylmethanamine
CID 115237605
N-[(2-methyl-1,3-benzoxazol-6-yl)methyl]-1-morpholin-2-ylmethanamine
CID 115237653
2-[2-(4-tert-butylphenyl)ethyl]morpholine
CID 83652133
2-morpholin-2-yl-N-(2-phenylethyl)acetamide
CID 66434342
N-[(3-methylphenyl)methyl]-2-morpholin-2-ylethanamine
CID 115239213
4-(2-methylpropyl)-N-(morpholin-2-ylmethyl)aniline
CID 115237440
N-[(3-fluoro-4-methoxyphenyl)methyl]-2-morpholin-2-ylethanamine
CID 115239190
2-(4-chlorophenyl)-N-(oxolan-2-ylmethyl)ethanamine
CID 54797397
2-morpholin-2-yl-N-[2-(4-sulfamoylphenyl)ethyl]acetamide;hydrochloride
CID 119673762
N-methyl-2-morpholin-2-ylethanamine
CID 14652595
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-morpholin-2-ylacetamide
CID 119675375

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenyl)-N-(morpholin-2-ylmethyl)ethanamine?
The IUPAC name of 2-(4-ethylphenyl)-N-(morpholin-2-ylmethyl)ethanamine (CID 115237698) is 2-(4-ethylphenyl)-N-(morpholin-2-ylmethyl)ethanamine.
What is the SMILES notation for 2-(4-ethylphenyl)-N-(morpholin-2-ylmethyl)ethanamine?
The canonical SMILES for 2-(4-ethylphenyl)-N-(morpholin-2-ylmethyl)ethanamine is CCc1ccc(CCNCC2CNCCO2)cc1.
What is the InChIKey of 2-(4-ethylphenyl)-N-(morpholin-2-ylmethyl)ethanamine?
The InChIKey is MXBZLGJFJLBIBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-2-13-3-5-14(6-4-13)7-8-16-11-15-12-17-9-10-18-15/h3-6,15-17H,2,7-12H2,1H3.
What are the key properties of 2-(4-ethylphenyl)-N-(morpholin-2-ylmethyl)ethanamine?
2-(4-ethylphenyl)-N-(morpholin-2-ylmethyl)ethanamine has a molecular weight of 248.37 g/mol, XLogP of 1.37, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenyl)-N-(morpholin-2-ylmethyl)ethanamine is sourced from PubChem (CID 115237698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).