N-(2-aminoethyl)-1-propanoylpiperidine-3-carboxamide;hydrochloride

C11H22ClN3O2 — CID 119385384

IUPACN-(2-aminoethyl)-1-propanoylpiperidine-3-carboxamide;hydrochloride
SMILESCCC(=O)N1CCCC(C(=O)NCCN)C1.Cl
InChIInChI=1S/C11H21N3O2.ClH/c1-2-10(15)14-7-3-4-9(8-14)11(16)13-6-5-12;/h9H,2-8,12H2,1H3,(H,13,16);1H
InChIKeyZCJLETBZTDEMDI-UHFFFAOYSA-N
MW263.77 g/mol
LogP0.13
Rot. Bonds4

About N-(2-aminoethyl)-1-propanoylpiperidine-3-carboxamide;hydrochloride

N-(2-aminoethyl)-1-propanoylpiperidine-3-carboxamide;hydrochloride (PubChem CID 119385384) has the molecular formula C11H22ClN3O2 and a molecular weight of 263.77 g/mol. Its IUPAC name is N-(2-aminoethyl)-1-propanoylpiperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-aminoethyl)-1-propanoylpiperidine-3-carboxamide;hydrochloride
PubChem CID119385384
Molecular FormulaC11H22ClN3O2
Molecular Weight263.77 g/mol
Exact Mass263.14
IUPAC NameN-(2-aminoethyl)-1-propanoylpiperidine-3-carboxamide;hydrochloride
SMILESCCC(=O)N1CCCC(C(=O)NCCN)C1.Cl
InChIInChI=1S/C11H21N3O2.ClH/c1-2-10(15)14-7-3-4-9(8-14)11(16)13-6-5-12;/h9H,2-8,12H2,1H3,(H,13,16);1H
InChIKeyZCJLETBZTDEMDI-UHFFFAOYSA-N
XLogP0.13
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.77
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-aminoethyl)-1-(3,3-dimethylbutanoyl)piperidine-3-carboxamide;hydrochloride
CID 119479684
N-ethyl-1-propanoylpiperidine-3-carboxamide
CID 68576487
N-(2-aminoethyl)-1-(2-cyclohexylacetyl)piperidine-3-carboxamide;hydrochloride
CID 119260266
1-(3-aminopropanoyl)-N-propylpiperidine-3-carboxamide;hydrochloride
CID 119311754
N-(2-aminoethyl)-1-(2-cyclobutylacetyl)piperidine-3-carboxamide
CID 103806108
N-(3-hydroxybutyl)-1-propanoylpiperidine-3-carboxamide
CID 111429215
N-(3-aminopropyl)-1-butanoylpiperidine-3-carboxamide;hydrochloride
CID 119407805
N-(2-aminoethyl)-1-[3-(cyclohexanecarbonylamino)butanoyl]piperidine-3-carboxamide
CID 119479921
N-(2-aminoethyl)-1-(3-propoxypropanoyl)piperidine-3-carboxamide
CID 63252023
N-(2-aminoethyl)-1-(1-ethylcyclobutanecarbonyl)piperidine-3-carboxamide;hydrochloride
CID 119480453
N-(2-aminoethyl)-1-(2-methoxypropanoyl)piperidine-3-carboxamide;hydrochloride
CID 119482363
N-(2-aminoethyl)-1-pent-4-enoylpiperidine-3-carboxamide
CID 63251976

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-1-propanoylpiperidine-3-carboxamide;hydrochloride?
The IUPAC name of N-(2-aminoethyl)-1-propanoylpiperidine-3-carboxamide;hydrochloride (CID 119385384) is N-(2-aminoethyl)-1-propanoylpiperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-aminoethyl)-1-propanoylpiperidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(2-aminoethyl)-1-propanoylpiperidine-3-carboxamide;hydrochloride is CCC(=O)N1CCCC(C(=O)NCCN)C1.Cl.
What is the InChIKey of N-(2-aminoethyl)-1-propanoylpiperidine-3-carboxamide;hydrochloride?
The InChIKey is ZCJLETBZTDEMDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2.ClH/c1-2-10(15)14-7-3-4-9(8-14)11(16)13-6-5-12;/h9H,2-8,12H2,1H3,(H,13,16);1H.
What are the key properties of N-(2-aminoethyl)-1-propanoylpiperidine-3-carboxamide;hydrochloride?
N-(2-aminoethyl)-1-propanoylpiperidine-3-carboxamide;hydrochloride has a molecular weight of 263.77 g/mol, XLogP of 0.13, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-1-propanoylpiperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119385384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).