(R)-(3-ethoxy-4-methoxyphenyl)-piperidin-4-ylmethanamine

C15H24N2O2 — CID 171314559

IUPAC(R)-(3-ethoxy-4-methoxyphenyl)-piperidin-4-ylmethanamine
SMILESCCOc1cc([C@H](N)C2CCNCC2)ccc1OC
InChIInChI=1S/C15H24N2O2/c1-3-19-14-10-12(4-5-13(14)18-2)15(16)11-6-8-17-9-7-11/h4-5,10-11,15,17H,3,6-9,16H2,1-2H3/t15-/m1/s1
InChIKeyGBXQZCLSAGIMPK-OAHLLOKOSA-N
MW264.37 g/mol
LogP2.09
Rot. Bonds5

About (R)-(3-ethoxy-4-methoxyphenyl)-piperidin-4-ylmethanamine

(R)-(3-ethoxy-4-methoxyphenyl)-piperidin-4-ylmethanamine (PubChem CID 171314559) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is (R)-(3-ethoxy-4-methoxyphenyl)-piperidin-4-ylmethanamine.

Molecular Properties

Compound Name(R)-(3-ethoxy-4-methoxyphenyl)-piperidin-4-ylmethanamine
PubChem CID171314559
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name(R)-(3-ethoxy-4-methoxyphenyl)-piperidin-4-ylmethanamine
SMILESCCOc1cc([C@H](N)C2CCNCC2)ccc1OC
InChIInChI=1S/C15H24N2O2/c1-3-19-14-10-12(4-5-13(14)18-2)15(16)11-6-8-17-9-7-11/h4-5,10-11,15,17H,3,6-9,16H2,1-2H3/t15-/m1/s1
InChIKeyGBXQZCLSAGIMPK-OAHLLOKOSA-N
XLogP2.09
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(S)-cyclopropyl-(4-ethoxy-3-methoxyphenyl)methanamine
CID 171231843
4-[(R)-amino(piperidin-4-yl)methyl]-2-ethoxyphenol;hydrochloride
CID 171314179
(R)-(3-ethoxy-4-phenylmethoxyphenyl)-piperidin-4-ylmethanamine;hydrochloride
CID 171314543
(3-bromo-4-methoxyphenyl)-piperidin-4-ylmethanamine
CID 82308332
(S)-(4-ethoxy-3-methoxyphenyl)-(oxan-4-yl)methanamine;hydrochloride
CID 171243693
azetidin-3-yl-(3,4-dimethoxyphenyl)methanamine
CID 116935281
4-[(R)-amino(cyclopropyl)methyl]-2-ethoxyphenol
CID 171200844
1-[(S)-cyclobutyl-(3-ethoxy-4-methoxyphenyl)methyl]piperazine;dihydrochloride
CID 171280900
1-(3-ethoxy-4-methoxyphenyl)ethanamine;hydrochloride
CID 22669266
(1R)-1-(3-ethoxy-4-methoxyphenyl)ethanamine;hydrochloride
CID 171210806
4-[(S)-amino(cyclopropyl)methyl]-2-ethoxyphenol;hydrochloride
CID 171220383
(S)-cyclopropyl-(3-ethoxy-4-phenylmethoxyphenyl)methanamine;hydrochloride
CID 171230032

Frequently Asked Questions

What is the IUPAC name of (R)-(3-ethoxy-4-methoxyphenyl)-piperidin-4-ylmethanamine?
The IUPAC name of (R)-(3-ethoxy-4-methoxyphenyl)-piperidin-4-ylmethanamine (CID 171314559) is (R)-(3-ethoxy-4-methoxyphenyl)-piperidin-4-ylmethanamine.
What is the SMILES notation for (R)-(3-ethoxy-4-methoxyphenyl)-piperidin-4-ylmethanamine?
The canonical SMILES for (R)-(3-ethoxy-4-methoxyphenyl)-piperidin-4-ylmethanamine is CCOc1cc([C@H](N)C2CCNCC2)ccc1OC.
What is the InChIKey of (R)-(3-ethoxy-4-methoxyphenyl)-piperidin-4-ylmethanamine?
The InChIKey is GBXQZCLSAGIMPK-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-3-19-14-10-12(4-5-13(14)18-2)15(16)11-6-8-17-9-7-11/h4-5,10-11,15,17H,3,6-9,16H2,1-2H3/t15-/m1/s1.
What are the key properties of (R)-(3-ethoxy-4-methoxyphenyl)-piperidin-4-ylmethanamine?
(R)-(3-ethoxy-4-methoxyphenyl)-piperidin-4-ylmethanamine has a molecular weight of 264.37 g/mol, XLogP of 2.09, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(3-ethoxy-4-methoxyphenyl)-piperidin-4-ylmethanamine is sourced from PubChem (CID 171314559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).