2-(4-amino-3-methylpiperidin-1-yl)-N-propylacetamide;hydrochloride

C11H24ClN3O — CID 119925069

IUPAC2-(4-amino-3-methylpiperidin-1-yl)-N-propylacetamide;hydrochloride
SMILESCCCNC(=O)CN1CCC(N)C(C)C1.Cl
InChIInChI=1S/C11H23N3O.ClH/c1-3-5-13-11(15)8-14-6-4-10(12)9(2)7-14;/h9-10H,3-8,12H2,1-2H3,(H,13,15);1H
InChIKeyBPPKGIVEUFTNFB-UHFFFAOYSA-N
MW249.79 g/mol
LogP0.60
Rot. Bonds4

About 2-(4-amino-3-methylpiperidin-1-yl)-N-propylacetamide;hydrochloride

2-(4-amino-3-methylpiperidin-1-yl)-N-propylacetamide;hydrochloride (PubChem CID 119925069) has the molecular formula C11H24ClN3O and a molecular weight of 249.79 g/mol. Its IUPAC name is 2-(4-amino-3-methylpiperidin-1-yl)-N-propylacetamide;hydrochloride.

Molecular Properties

Compound Name2-(4-amino-3-methylpiperidin-1-yl)-N-propylacetamide;hydrochloride
PubChem CID119925069
Molecular FormulaC11H24ClN3O
Molecular Weight249.79 g/mol
Exact Mass249.16
IUPAC Name2-(4-amino-3-methylpiperidin-1-yl)-N-propylacetamide;hydrochloride
SMILESCCCNC(=O)CN1CCC(N)C(C)C1.Cl
InChIInChI=1S/C11H23N3O.ClH/c1-3-5-13-11(15)8-14-6-4-10(12)9(2)7-14;/h9-10H,3-8,12H2,1-2H3,(H,13,15);1H
InChIKeyBPPKGIVEUFTNFB-UHFFFAOYSA-N
XLogP0.60
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.79
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-amino-3-methylpiperidin-1-yl)-N-prop-2-enylacetamide;hydrochloride
CID 119925040
1-[2-oxo-2-(propylamino)ethyl]pyrrolidine-3-carboxylic acid
CID 22322508
2-(4-amino-3-methylpiperidin-1-yl)-N,N-dipropylacetamide;hydrochloride
CID 119925188
2-(3-amino-4-methylpyrrolidin-1-yl)-N-(propylcarbamoyl)acetamide
CID 103576948
2-(3-aminopyrrolidin-1-yl)-N-butylacetamide
CID 62067276
N-(2-aminoethyl)-2-(4-hydroxy-3-methylpiperidin-1-yl)acetamide
CID 114678035
3-(4-amino-3-methylpiperidin-1-yl)-N-ethylpropanamide
CID 79868702
2-(4-amino-3-methylpiperidin-1-yl)-N-(2-chlorophenyl)acetamide;hydrochloride
CID 119925180
2-(4-amino-3-methylpiperidin-1-yl)-N-(2-fluorophenyl)acetamide;hydrochloride
CID 119925182
2-(4-amino-3-methylpiperidin-1-yl)-N-(2,5-dimethylphenyl)acetamide
CID 79868364
2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-phenylethyl)acetamide
CID 81451615
N-propyl-2-pyrrolidin-1-ylacetamide
CID 22117904

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-3-methylpiperidin-1-yl)-N-propylacetamide;hydrochloride?
The IUPAC name of 2-(4-amino-3-methylpiperidin-1-yl)-N-propylacetamide;hydrochloride (CID 119925069) is 2-(4-amino-3-methylpiperidin-1-yl)-N-propylacetamide;hydrochloride.
What is the SMILES notation for 2-(4-amino-3-methylpiperidin-1-yl)-N-propylacetamide;hydrochloride?
The canonical SMILES for 2-(4-amino-3-methylpiperidin-1-yl)-N-propylacetamide;hydrochloride is CCCNC(=O)CN1CCC(N)C(C)C1.Cl.
What is the InChIKey of 2-(4-amino-3-methylpiperidin-1-yl)-N-propylacetamide;hydrochloride?
The InChIKey is BPPKGIVEUFTNFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O.ClH/c1-3-5-13-11(15)8-14-6-4-10(12)9(2)7-14;/h9-10H,3-8,12H2,1-2H3,(H,13,15);1H.
What are the key properties of 2-(4-amino-3-methylpiperidin-1-yl)-N-propylacetamide;hydrochloride?
2-(4-amino-3-methylpiperidin-1-yl)-N-propylacetamide;hydrochloride has a molecular weight of 249.79 g/mol, XLogP of 0.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-3-methylpiperidin-1-yl)-N-propylacetamide;hydrochloride is sourced from PubChem (CID 119925069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).