1-ethyl-N-[2-(4-methoxyphenyl)ethyl]piperidin-4-amine

C16H26N2O — CID 3824332

IUPAC1-ethyl-N-[2-(4-methoxyphenyl)ethyl]piperidin-4-amine
SMILESCCN1CCC(NCCc2ccc(OC)cc2)CC1
InChIInChI=1S/C16H26N2O/c1-3-18-12-9-15(10-13-18)17-11-8-14-4-6-16(19-2)7-5-14/h4-7,15,17H,3,8-13H2,1-2H3
InChIKeyBQVVBNOLAXNHMC-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.31
Rot. Bonds6

About 1-ethyl-N-[2-(4-methoxyphenyl)ethyl]piperidin-4-amine

1-ethyl-N-[2-(4-methoxyphenyl)ethyl]piperidin-4-amine (PubChem CID 3824332) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 1-ethyl-N-[2-(4-methoxyphenyl)ethyl]piperidin-4-amine.

Molecular Properties

Compound Name1-ethyl-N-[2-(4-methoxyphenyl)ethyl]piperidin-4-amine
PubChem CID3824332
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name1-ethyl-N-[2-(4-methoxyphenyl)ethyl]piperidin-4-amine
SMILESCCN1CCC(NCCc2ccc(OC)cc2)CC1
InChIInChI=1S/C16H26N2O/c1-3-18-12-9-15(10-13-18)17-11-8-14-4-6-16(19-2)7-5-14/h4-7,15,17H,3,8-13H2,1-2H3
InChIKeyBQVVBNOLAXNHMC-UHFFFAOYSA-N
XLogP2.31
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-[(1-ethylpiperidin-4-yl)amino]ethyl]phenol
CID 61239241
1-ethyl-N-[2-(3-methoxyphenyl)ethyl]azepan-4-amine
CID 107850209
N-[2-(4-methoxyphenyl)ethyl]cyclohexanamine;hydrochloride
CID 23106150
N-(1-ethylpiperidin-4-yl)-3-(4-methoxyphenyl)propanamide
CID 17250230
N-[1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl]-N',N'-dimethylethane-1,2-diamine
CID 24732624
1-ethyl-N-[2-(4-nitrophenyl)ethyl]piperidin-4-amine
CID 61219668
1-ethyl-2-[2-(1-ethylpiperidin-4-yl)ethyl]-3-[2-(4-methoxyphenyl)ethyl]guanidine
CID 111781405
N-[(4-ethoxyphenyl)methyl]-1-ethylpiperidin-4-amine
CID 60657865
N-[1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl]thiohydroxylamine
CID 123350321
N-(2-phenylethyl)-1-(2,2,2-trideuterioethyl)piperidin-4-amine
CID 118109233
N-[2-(4-methoxyphenyl)ethyl]-9-methyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 65472958
trans-(1R,3R)-N-[2-(4-methoxyphenyl)ethyl]-3-methylcyclohexan-1-amine
CID 784361

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[2-(4-methoxyphenyl)ethyl]piperidin-4-amine?
The IUPAC name of 1-ethyl-N-[2-(4-methoxyphenyl)ethyl]piperidin-4-amine (CID 3824332) is 1-ethyl-N-[2-(4-methoxyphenyl)ethyl]piperidin-4-amine.
What is the SMILES notation for 1-ethyl-N-[2-(4-methoxyphenyl)ethyl]piperidin-4-amine?
The canonical SMILES for 1-ethyl-N-[2-(4-methoxyphenyl)ethyl]piperidin-4-amine is CCN1CCC(NCCc2ccc(OC)cc2)CC1.
What is the InChIKey of 1-ethyl-N-[2-(4-methoxyphenyl)ethyl]piperidin-4-amine?
The InChIKey is BQVVBNOLAXNHMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-3-18-12-9-15(10-13-18)17-11-8-14-4-6-16(19-2)7-5-14/h4-7,15,17H,3,8-13H2,1-2H3.
What are the key properties of 1-ethyl-N-[2-(4-methoxyphenyl)ethyl]piperidin-4-amine?
1-ethyl-N-[2-(4-methoxyphenyl)ethyl]piperidin-4-amine has a molecular weight of 262.40 g/mol, XLogP of 2.31, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[2-(4-methoxyphenyl)ethyl]piperidin-4-amine is sourced from PubChem (CID 3824332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).