1-[2-(2-ethoxyphenoxy)ethyl]-N,4-dimethylpiperidin-4-amine

C17H28N2O2 — CID 115305364

IUPAC1-[2-(2-ethoxyphenoxy)ethyl]-N,4-dimethylpiperidin-4-amine
SMILESCCOc1ccccc1OCCN1CCC(C)(NC)CC1
InChIInChI=1S/C17H28N2O2/c1-4-20-15-7-5-6-8-16(15)21-14-13-19-11-9-17(2,18-3)10-12-19/h5-8,18H,4,9-14H2,1-3H3
InChIKeyPTEIRIYBGKDWNU-UHFFFAOYSA-N
MW292.42 g/mol
LogP2.54
Rot. Bonds7

About 1-[2-(2-ethoxyphenoxy)ethyl]-N,4-dimethylpiperidin-4-amine

1-[2-(2-ethoxyphenoxy)ethyl]-N,4-dimethylpiperidin-4-amine (PubChem CID 115305364) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is 1-[2-(2-ethoxyphenoxy)ethyl]-N,4-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-[2-(2-ethoxyphenoxy)ethyl]-N,4-dimethylpiperidin-4-amine
PubChem CID115305364
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name1-[2-(2-ethoxyphenoxy)ethyl]-N,4-dimethylpiperidin-4-amine
SMILESCCOc1ccccc1OCCN1CCC(C)(NC)CC1
InChIInChI=1S/C17H28N2O2/c1-4-20-15-7-5-6-8-16(15)21-14-13-19-11-9-17(2,18-3)10-12-19/h5-8,18H,4,9-14H2,1-3H3
InChIKeyPTEIRIYBGKDWNU-UHFFFAOYSA-N
XLogP2.54
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-ethoxyphenyl)-[4-methyl-4-(methylamino)piperidin-1-yl]methanone
CID 115304464
[1-[2-(2-ethoxyphenoxy)ethyl]piperidin-4-yl]methanamine;hydrochloride
CID 119909159
1-[2-(2-ethoxyphenoxy)ethyl]-1,4-diazepane;hydrochloride
CID 119906010
3-(2-bromoethyl)-1-[2-(2-ethoxyphenoxy)ethyl]pyrrolidine
CID 114800481
N,4-dimethyl-1-[2-(2-methylpropoxy)ethyl]piperidin-4-amine
CID 106455102
1-[2-(2-butoxyphenoxy)ethyl]-4-methylpiperazine;hydrochloride
CID 2996491
4-chloro-1-[2-(2-ethoxyphenoxy)ethyl]-3-methylpiperidine
CID 114682320
1-[2-(2-ethoxyphenoxy)ethyl]-3-[(4-methylphenyl)methyl]imidazolidine
CID 155801878
1-[2-(2-methoxyphenoxy)ethyl]piperidine
CID 867242
1-[[2-(difluoromethoxy)phenyl]methyl]-N,4-dimethylpiperidin-4-amine
CID 115303878
1-[3-ethoxy-2-(2-pyrrolidin-1-ylethoxy)phenyl]-N-methylmethanamine
CID 60883395
3-[2-(2-ethoxyphenoxy)ethyl]-3-methylazetidine
CID 79451109

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-ethoxyphenoxy)ethyl]-N,4-dimethylpiperidin-4-amine?
The IUPAC name of 1-[2-(2-ethoxyphenoxy)ethyl]-N,4-dimethylpiperidin-4-amine (CID 115305364) is 1-[2-(2-ethoxyphenoxy)ethyl]-N,4-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-[2-(2-ethoxyphenoxy)ethyl]-N,4-dimethylpiperidin-4-amine?
The canonical SMILES for 1-[2-(2-ethoxyphenoxy)ethyl]-N,4-dimethylpiperidin-4-amine is CCOc1ccccc1OCCN1CCC(C)(NC)CC1.
What is the InChIKey of 1-[2-(2-ethoxyphenoxy)ethyl]-N,4-dimethylpiperidin-4-amine?
The InChIKey is PTEIRIYBGKDWNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-4-20-15-7-5-6-8-16(15)21-14-13-19-11-9-17(2,18-3)10-12-19/h5-8,18H,4,9-14H2,1-3H3.
What are the key properties of 1-[2-(2-ethoxyphenoxy)ethyl]-N,4-dimethylpiperidin-4-amine?
1-[2-(2-ethoxyphenoxy)ethyl]-N,4-dimethylpiperidin-4-amine has a molecular weight of 292.42 g/mol, XLogP of 2.54, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-ethoxyphenoxy)ethyl]-N,4-dimethylpiperidin-4-amine is sourced from PubChem (CID 115305364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).