2-[1-(2-ethoxyphenyl)piperidin-3-yl]ethanamine

C15H24N2O — CID 117002698

IUPAC2-[1-(2-ethoxyphenyl)piperidin-3-yl]ethanamine
SMILESCCOc1ccccc1N1CCCC(CCN)C1
InChIInChI=1S/C15H24N2O/c1-2-18-15-8-4-3-7-14(15)17-11-5-6-13(12-17)9-10-16/h3-4,7-8,13H,2,5-6,9-12,16H2,1H3
InChIKeyWZHBOVVCAMNHFD-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.65
Rot. Bonds5

About 2-[1-(2-ethoxyphenyl)piperidin-3-yl]ethanamine

2-[1-(2-ethoxyphenyl)piperidin-3-yl]ethanamine (PubChem CID 117002698) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-[1-(2-ethoxyphenyl)piperidin-3-yl]ethanamine.

Molecular Properties

Compound Name2-[1-(2-ethoxyphenyl)piperidin-3-yl]ethanamine
PubChem CID117002698
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-[1-(2-ethoxyphenyl)piperidin-3-yl]ethanamine
SMILESCCOc1ccccc1N1CCCC(CCN)C1
InChIInChI=1S/C15H24N2O/c1-2-18-15-8-4-3-7-14(15)17-11-5-6-13(12-17)9-10-16/h3-4,7-8,13H,2,5-6,9-12,16H2,1H3
InChIKeyWZHBOVVCAMNHFD-UHFFFAOYSA-N
XLogP2.65
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(2-ethoxyphenyl)pyrrolidin-3-yl]ethanol
CID 117028471
N-[[1-(2-ethoxyphenyl)pyrrolidin-3-yl]methyl]ethanamine
CID 54792876
2-ethoxy-6-(3-propylpyrrolidin-1-yl)aniline
CID 113416878
1-[2-(3-fluoropropoxy)phenyl]piperidin-3-amine
CID 81113423
2-[3-(2-aminoethyl)piperidin-1-yl]-N-(2-ethoxyphenyl)acetamide;hydrochloride
CID 120728365
2-[1-(3-ethoxy-2-pyridinyl)piperidin-3-yl]ethanol
CID 113371177
1-(2-ethoxyphenyl)-4-methyl-1,5-diazocane
CID 54973542
2-[1-(4-fluorophenyl)piperidin-3-yl]ethanamine
CID 83822888
4-[3-(2-aminoethyl)piperidin-1-yl]-1-methylquinolin-2-one
CID 81244041
N-cyclopentyl-4-(2-ethoxyphenyl)piperazine-1-carbothioamide
CID 19655264
2-[1-(4-chlorophenyl)piperidin-3-yl]ethanamine
CID 83824658
1-[2-[(5-methyloxolan-2-yl)methoxy]phenyl]piperidin-3-amine
CID 103137218

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-ethoxyphenyl)piperidin-3-yl]ethanamine?
The IUPAC name of 2-[1-(2-ethoxyphenyl)piperidin-3-yl]ethanamine (CID 117002698) is 2-[1-(2-ethoxyphenyl)piperidin-3-yl]ethanamine.
What is the SMILES notation for 2-[1-(2-ethoxyphenyl)piperidin-3-yl]ethanamine?
The canonical SMILES for 2-[1-(2-ethoxyphenyl)piperidin-3-yl]ethanamine is CCOc1ccccc1N1CCCC(CCN)C1.
What is the InChIKey of 2-[1-(2-ethoxyphenyl)piperidin-3-yl]ethanamine?
The InChIKey is WZHBOVVCAMNHFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-2-18-15-8-4-3-7-14(15)17-11-5-6-13(12-17)9-10-16/h3-4,7-8,13H,2,5-6,9-12,16H2,1H3.
What are the key properties of 2-[1-(2-ethoxyphenyl)piperidin-3-yl]ethanamine?
2-[1-(2-ethoxyphenyl)piperidin-3-yl]ethanamine has a molecular weight of 248.37 g/mol, XLogP of 2.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-ethoxyphenyl)piperidin-3-yl]ethanamine is sourced from PubChem (CID 117002698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).