(4-ethoxyphenyl)-piperidin-2-ylmethanamine

C14H22N2O — CID 116935668

IUPAC(4-ethoxyphenyl)-piperidin-2-ylmethanamine
SMILESCCOc1ccc(C(N)C2CCCCN2)cc1
InChIInChI=1S/C14H22N2O/c1-2-17-12-8-6-11(7-9-12)14(15)13-5-3-4-10-16-13/h6-9,13-14,16H,2-5,10,15H2,1H3
InChIKeyJZBBWZBVKOUOTH-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.23
Rot. Bonds4

About (4-ethoxyphenyl)-piperidin-2-ylmethanamine

(4-ethoxyphenyl)-piperidin-2-ylmethanamine (PubChem CID 116935668) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is (4-ethoxyphenyl)-piperidin-2-ylmethanamine.

Molecular Properties

Compound Name(4-ethoxyphenyl)-piperidin-2-ylmethanamine
PubChem CID116935668
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name(4-ethoxyphenyl)-piperidin-2-ylmethanamine
SMILESCCOc1ccc(C(N)C2CCCCN2)cc1
InChIInChI=1S/C14H22N2O/c1-2-17-12-8-6-11(7-9-12)14(15)13-5-3-4-10-16-13/h6-9,13-14,16H,2-5,10,15H2,1H3
InChIKeyJZBBWZBVKOUOTH-UHFFFAOYSA-N
XLogP2.23
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(4-fluorophenyl)-piperidin-2-ylmethanamine
CID 116935636
(4-bromophenyl)-piperidin-2-ylmethanamine
CID 116935638
(4-ethoxyphenyl)-piperidin-3-ylmethanamine
CID 116935799
(2,2-dimethylcyclohexyl)-(4-ethoxyphenyl)methanamine
CID 107176964
(2R)-2-[2-(4-ethoxyphenoxy)ethyl]piperidine
CID 28749865
(4-fluoro-3-methylphenyl)-piperidin-2-ylmethanamine
CID 116935640
2-cyclopropyl-1-(4-ethoxyphenyl)propan-1-amine
CID 83153985
4-[amino-(4-ethoxyphenyl)methyl]-N-methylcyclohexan-1-amine
CID 116937243
(4-ethoxyphenyl)-(3-ethylcyclohexyl)methanamine
CID 65415745
(4-ethoxyphenyl)-(4-propylcyclohexyl)methanamine
CID 65422984
4-[(4-aminophenyl)-(4-ethoxyphenyl)methyl]aniline
CID 59136500
3,4-dihydro-2H-1,5-benzodioxepin-7-yl(piperidin-2-yl)methanamine
CID 116935656

Frequently Asked Questions

What is the IUPAC name of (4-ethoxyphenyl)-piperidin-2-ylmethanamine?
The IUPAC name of (4-ethoxyphenyl)-piperidin-2-ylmethanamine (CID 116935668) is (4-ethoxyphenyl)-piperidin-2-ylmethanamine.
What is the SMILES notation for (4-ethoxyphenyl)-piperidin-2-ylmethanamine?
The canonical SMILES for (4-ethoxyphenyl)-piperidin-2-ylmethanamine is CCOc1ccc(C(N)C2CCCCN2)cc1.
What is the InChIKey of (4-ethoxyphenyl)-piperidin-2-ylmethanamine?
The InChIKey is JZBBWZBVKOUOTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-2-17-12-8-6-11(7-9-12)14(15)13-5-3-4-10-16-13/h6-9,13-14,16H,2-5,10,15H2,1H3.
What are the key properties of (4-ethoxyphenyl)-piperidin-2-ylmethanamine?
(4-ethoxyphenyl)-piperidin-2-ylmethanamine has a molecular weight of 234.34 g/mol, XLogP of 2.23, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethoxyphenyl)-piperidin-2-ylmethanamine is sourced from PubChem (CID 116935668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).