1-(1-benzylpiperidin-4-yl)-N-ethylethanamine

C16H26N2 — CID 63854656

IUPAC1-(1-benzylpiperidin-4-yl)-N-ethylethanamine
SMILESCCNC(C)C1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C16H26N2/c1-3-17-14(2)16-9-11-18(12-10-16)13-15-7-5-4-6-8-15/h4-8,14,16-17H,3,9-13H2,1-2H3
InChIKeyVOSJUAMYFWNMMP-UHFFFAOYSA-N
MW246.40 g/mol
LogP2.90
Rot. Bonds5

About 1-(1-benzylpiperidin-4-yl)-N-ethylethanamine

1-(1-benzylpiperidin-4-yl)-N-ethylethanamine (PubChem CID 63854656) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is 1-(1-benzylpiperidin-4-yl)-N-ethylethanamine.

Molecular Properties

Compound Name1-(1-benzylpiperidin-4-yl)-N-ethylethanamine
PubChem CID63854656
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC Name1-(1-benzylpiperidin-4-yl)-N-ethylethanamine
SMILESCCNC(C)C1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C16H26N2/c1-3-17-14(2)16-9-11-18(12-10-16)13-15-7-5-4-6-8-15/h4-8,14,16-17H,3,9-13H2,1-2H3
InChIKeyVOSJUAMYFWNMMP-UHFFFAOYSA-N
XLogP2.90
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(1-benzylpiperidin-4-yl)-N-ethylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(1R)-1-[(3R)-1-benzylpyrrolidin-3-yl]ethyl]-3-phenylpropan-1-amine
CID 97341089
1-(1-benzylpyrrolidin-3-yl)-N-ethylpropan-2-amine
CID 83980661
1-(1-benzylpyrrolidin-3-yl)ethylthiourea
CID 131219663
(1R)-1-[(3S)-1-benzylpyrrolidin-3-yl]ethanol
CID 96766487
1-benzyl-N-methylpiperidin-4-amine
CID 4136128
2-[(1-benzylpiperidin-4-yl)amino]propan-1-ol
CID 43499736
1-[2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]ethyl]pyridin-2-one
CID 82897001
N-ethyl-1-[1-[(4-ethylphenyl)methyl]piperidin-3-yl]ethanamine
CID 63853942
(1S)-1-(1-benzylpyrrolidin-3-yl)propan-1-amine
CID 10443395
(1S)-1-[(3S)-1-benzylpyrrolidin-3-yl]ethanamine;dihydrochloride
CID 71741811
1-(1-benzylpiperidin-4-yl)-3-methylbutan-2-amine
CID 83983169
1-(1-benzylpyrrolidin-3-yl)-2-methylpropan-1-amine
CID 82390240

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzylpiperidin-4-yl)-N-ethylethanamine?
The IUPAC name of 1-(1-benzylpiperidin-4-yl)-N-ethylethanamine (CID 63854656) is 1-(1-benzylpiperidin-4-yl)-N-ethylethanamine.
What is the SMILES notation for 1-(1-benzylpiperidin-4-yl)-N-ethylethanamine?
The canonical SMILES for 1-(1-benzylpiperidin-4-yl)-N-ethylethanamine is CCNC(C)C1CCN(Cc2ccccc2)CC1.
What is the InChIKey of 1-(1-benzylpiperidin-4-yl)-N-ethylethanamine?
The InChIKey is VOSJUAMYFWNMMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c1-3-17-14(2)16-9-11-18(12-10-16)13-15-7-5-4-6-8-15/h4-8,14,16-17H,3,9-13H2,1-2H3.
What are the key properties of 1-(1-benzylpiperidin-4-yl)-N-ethylethanamine?
1-(1-benzylpiperidin-4-yl)-N-ethylethanamine has a molecular weight of 246.40 g/mol, XLogP of 2.90, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzylpiperidin-4-yl)-N-ethylethanamine is sourced from PubChem (CID 63854656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).