2-[3-(ethylaminomethyl)piperidin-1-yl]-N-methylacetamide

C11H23N3O — CID 63849498

IUPAC2-[3-(ethylaminomethyl)piperidin-1-yl]-N-methylacetamide
SMILESCCNCC1CCCN(CC(=O)NC)C1
InChIInChI=1S/C11H23N3O/c1-3-13-7-10-5-4-6-14(8-10)9-11(15)12-2/h10,13H,3-9H2,1-2H3,(H,12,15)
InChIKeyRYKIHPCACIPQCZ-UHFFFAOYSA-N
MW213.32 g/mol
LogP0.05
Rot. Bonds5

About 2-[3-(ethylaminomethyl)piperidin-1-yl]-N-methylacetamide

2-[3-(ethylaminomethyl)piperidin-1-yl]-N-methylacetamide (PubChem CID 63849498) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-[3-(ethylaminomethyl)piperidin-1-yl]-N-methylacetamide.

Molecular Properties

Compound Name2-[3-(ethylaminomethyl)piperidin-1-yl]-N-methylacetamide
PubChem CID63849498
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name2-[3-(ethylaminomethyl)piperidin-1-yl]-N-methylacetamide
SMILESCCNCC1CCCN(CC(=O)NC)C1
InChIInChI=1S/C11H23N3O/c1-3-13-7-10-5-4-6-14(8-10)9-11(15)12-2/h10,13H,3-9H2,1-2H3,(H,12,15)
InChIKeyRYKIHPCACIPQCZ-UHFFFAOYSA-N
XLogP0.05
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(ethylaminomethyl)piperidin-1-yl]-N-propylacetamide
CID 63848807
N-[[1-(2-bromoprop-2-enyl)piperidin-3-yl]methyl]ethanamine
CID 63847588
2-[3-(methylaminomethyl)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride
CID 119914462
2-[3-(ethylaminomethyl)piperidin-1-yl]-N-(3-methylphenyl)acetamide
CID 63848456
N-ethyl-2-[3-(hydroxymethyl)piperidin-1-yl]acetamide
CID 60645129
5-[3-(ethylaminomethyl)piperidin-1-yl]pentan-1-ol
CID 63848813
4-[3-(ethylaminomethyl)piperidin-1-yl]-2-methylbutan-2-ol
CID 79354793
N-butan-2-yl-2-[3-[(2-methylpropylamino)methyl]piperidin-1-yl]acetamide
CID 63849022
N-methyl-4-[3-(propylaminomethyl)piperidin-1-yl]butanamide
CID 63890612
2-(3-methoxypiperidin-1-yl)-N-methylacetamide
CID 130708427
N-[[1-(3-methylbutyl)piperidin-3-yl]methyl]ethanamine
CID 62581148
N-(3-methylbutan-2-yl)-2-[3-(propylaminomethyl)piperidin-1-yl]acetamide
CID 63847249

Frequently Asked Questions

What is the IUPAC name of 2-[3-(ethylaminomethyl)piperidin-1-yl]-N-methylacetamide?
The IUPAC name of 2-[3-(ethylaminomethyl)piperidin-1-yl]-N-methylacetamide (CID 63849498) is 2-[3-(ethylaminomethyl)piperidin-1-yl]-N-methylacetamide.
What is the SMILES notation for 2-[3-(ethylaminomethyl)piperidin-1-yl]-N-methylacetamide?
The canonical SMILES for 2-[3-(ethylaminomethyl)piperidin-1-yl]-N-methylacetamide is CCNCC1CCCN(CC(=O)NC)C1.
What is the InChIKey of 2-[3-(ethylaminomethyl)piperidin-1-yl]-N-methylacetamide?
The InChIKey is RYKIHPCACIPQCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-3-13-7-10-5-4-6-14(8-10)9-11(15)12-2/h10,13H,3-9H2,1-2H3,(H,12,15).
What are the key properties of 2-[3-(ethylaminomethyl)piperidin-1-yl]-N-methylacetamide?
2-[3-(ethylaminomethyl)piperidin-1-yl]-N-methylacetamide has a molecular weight of 213.32 g/mol, XLogP of 0.05, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(ethylaminomethyl)piperidin-1-yl]-N-methylacetamide is sourced from PubChem (CID 63849498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).