2-[2-(aminomethyl)piperidin-1-yl]-N,N-diethylacetamide;hydrochloride

C12H26ClN3O — CID 120869605

IUPAC2-[2-(aminomethyl)piperidin-1-yl]-N,N-diethylacetamide;hydrochloride
SMILESCCN(CC)C(=O)CN1CCCCC1CN.Cl
InChIInChI=1S/C12H25N3O.ClH/c1-3-14(4-2)12(16)10-15-8-6-5-7-11(15)9-13;/h11H,3-10,13H2,1-2H3;1H
InChIKeyGJRZGUZZRXTGEC-UHFFFAOYSA-N
MW263.81 g/mol
LogP1.09
Rot. Bonds5

About 2-[2-(aminomethyl)piperidin-1-yl]-N,N-diethylacetamide;hydrochloride

2-[2-(aminomethyl)piperidin-1-yl]-N,N-diethylacetamide;hydrochloride (PubChem CID 120869605) has the molecular formula C12H26ClN3O and a molecular weight of 263.81 g/mol. Its IUPAC name is 2-[2-(aminomethyl)piperidin-1-yl]-N,N-diethylacetamide;hydrochloride.

Molecular Properties

Compound Name2-[2-(aminomethyl)piperidin-1-yl]-N,N-diethylacetamide;hydrochloride
PubChem CID120869605
Molecular FormulaC12H26ClN3O
Molecular Weight263.81 g/mol
Exact Mass263.18
IUPAC Name2-[2-(aminomethyl)piperidin-1-yl]-N,N-diethylacetamide;hydrochloride
SMILESCCN(CC)C(=O)CN1CCCCC1CN.Cl
InChIInChI=1S/C12H25N3O.ClH/c1-3-14(4-2)12(16)10-15-8-6-5-7-11(15)9-13;/h11H,3-10,13H2,1-2H3;1H
InChIKeyGJRZGUZZRXTGEC-UHFFFAOYSA-N
XLogP1.09
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.81
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(aminomethyl)piperidin-1-yl]-N-cyclopropyl-N-methylacetamide;hydrochloride
CID 119916251
2-[2-(aminomethyl)piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide
CID 43186999
N,N-diethyl-2-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]acetamide
CID 62733674
2-[2-(aminomethyl)pyrrolidin-1-yl]-N-cyclopropyl-N-ethylacetamide
CID 63760499
2-[2-(aminomethyl)pyrrolidin-1-yl]-N,N-di(propan-2-yl)acetamide;hydrochloride
CID 119926999
N,N-diethyl-2-[(2S)-2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]acetamide
CID 95261573
N,N-diethyl-2-[2-(2-oxopropyl)pyrrolidin-1-yl]acetamide
CID 79546901
2-[2-[(tert-butylamino)methyl]piperidin-1-yl]-N,N-diethylacetamide
CID 63849748
2-[2-(aminomethyl)piperidin-1-yl]-N-methyl-N-phenylacetamide;hydrochloride
CID 119916209
2-[2-(aminomethyl)piperidin-1-yl]-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide;hydrochloride
CID 119916207
2-[2-(aminomethyl)-3-ethylpiperidin-1-yl]-N,N-diethylacetamide
CID 82736942
1-[2-(diethylamino)-2-oxoethyl]piperidine-2-carboxylic acid
CID 43441021

Frequently Asked Questions

What is the IUPAC name of 2-[2-(aminomethyl)piperidin-1-yl]-N,N-diethylacetamide;hydrochloride?
The IUPAC name of 2-[2-(aminomethyl)piperidin-1-yl]-N,N-diethylacetamide;hydrochloride (CID 120869605) is 2-[2-(aminomethyl)piperidin-1-yl]-N,N-diethylacetamide;hydrochloride.
What is the SMILES notation for 2-[2-(aminomethyl)piperidin-1-yl]-N,N-diethylacetamide;hydrochloride?
The canonical SMILES for 2-[2-(aminomethyl)piperidin-1-yl]-N,N-diethylacetamide;hydrochloride is CCN(CC)C(=O)CN1CCCCC1CN.Cl.
What is the InChIKey of 2-[2-(aminomethyl)piperidin-1-yl]-N,N-diethylacetamide;hydrochloride?
The InChIKey is GJRZGUZZRXTGEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O.ClH/c1-3-14(4-2)12(16)10-15-8-6-5-7-11(15)9-13;/h11H,3-10,13H2,1-2H3;1H.
What are the key properties of 2-[2-(aminomethyl)piperidin-1-yl]-N,N-diethylacetamide;hydrochloride?
2-[2-(aminomethyl)piperidin-1-yl]-N,N-diethylacetamide;hydrochloride has a molecular weight of 263.81 g/mol, XLogP of 1.09, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(aminomethyl)piperidin-1-yl]-N,N-diethylacetamide;hydrochloride is sourced from PubChem (CID 120869605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).