2-[2-(1-aminoethyl)piperidin-1-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide

C15H29N3O — CID 55219331

IUPAC2-[2-(1-aminoethyl)piperidin-1-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide
SMILESC=C(C)CN(CC)C(=O)CN1CCCCC1C(C)N
InChIInChI=1S/C15H29N3O/c1-5-17(10-12(2)3)15(19)11-18-9-7-6-8-14(18)13(4)16/h13-14H,2,5-11,16H2,1,3-4H3
InChIKeyCZJQJJCZRAYCAT-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.61
Rot. Bonds6

About 2-[2-(1-aminoethyl)piperidin-1-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide

2-[2-(1-aminoethyl)piperidin-1-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide (PubChem CID 55219331) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-[2-(1-aminoethyl)piperidin-1-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide.

Molecular Properties

Compound Name2-[2-(1-aminoethyl)piperidin-1-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide
PubChem CID55219331
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name2-[2-(1-aminoethyl)piperidin-1-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide
SMILESC=C(C)CN(CC)C(=O)CN1CCCCC1C(C)N
InChIInChI=1S/C15H29N3O/c1-5-17(10-12(2)3)15(19)11-18-9-7-6-8-14(18)13(4)16/h13-14H,2,5-11,16H2,1,3-4H3
InChIKeyCZJQJJCZRAYCAT-UHFFFAOYSA-N
XLogP1.61
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 2-[2-(1-aminoethyl)piperidin-1-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide 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

2-[cyclohexyl(methyl)amino]-N-prop-2-enylacetamide
CID 51072753
N-butan-2-yl-2-(2-ethylpiperidin-1-yl)acetamide
CID 47006655
2-methyl-N-[2-(2-methylpiperidin-1-yl)ethyl]prop-2-enamide
CID 18464087
2-methyl-N-(6-piperazin-1-ylhexyl)prop-2-enamide
CID 18464104
2-(4-aminopiperidin-1-yl)-N-prop-2-enylacetamide
CID 43556590
4-(4-Methylidenecyclohexyl)piperazin-2-one
CID 58902675
1-(2-Ethylpiperidin-1-yl)-2-(propan-2-ylamino)ethanone
CID 60683032
1-(3-Aminopiperidin-1-yl)-3-methylbut-2-en-1-one
CID 61295908
(3S,6S)-3-butyl-6-prop-1-en-2-ylpiperazin-2-one
CID 89319819
2-methyl-N-(piperidin-2-ylmethyl)prop-2-enamide
CID 118554108
2-(2,6-dimethylpiperidin-1-yl)-N-prop-1-en-2-ylacetamide
CID 123318405
1-(3-Aminopiperidin-1-yl)-2-methylprop-2-en-1-one
CID 123753405

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1-aminoethyl)piperidin-1-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide?
The IUPAC name of 2-[2-(1-aminoethyl)piperidin-1-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide (CID 55219331) is 2-[2-(1-aminoethyl)piperidin-1-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide.
What is the SMILES notation for 2-[2-(1-aminoethyl)piperidin-1-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide?
The canonical SMILES for 2-[2-(1-aminoethyl)piperidin-1-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide is C=C(C)CN(CC)C(=O)CN1CCCCC1C(C)N.
What is the InChIKey of 2-[2-(1-aminoethyl)piperidin-1-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide?
The InChIKey is CZJQJJCZRAYCAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-5-17(10-12(2)3)15(19)11-18-9-7-6-8-14(18)13(4)16/h13-14H,2,5-11,16H2,1,3-4H3.
What are the key properties of 2-[2-(1-aminoethyl)piperidin-1-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide?
2-[2-(1-aminoethyl)piperidin-1-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide has a molecular weight of 267.42 g/mol, XLogP of 1.61, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1-aminoethyl)piperidin-1-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide is sourced from PubChem (CID 55219331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).