N-(2-aminoethyl)-2-piperidin-1-ylpyridine-3-carboxamide;dihydrochloride

C13H22Cl2N4O — CID 119383900

IUPACN-(2-aminoethyl)-2-piperidin-1-ylpyridine-3-carboxamide;dihydrochloride
SMILESCl.Cl.NCCNC(=O)c1cccnc1N1CCCCC1
InChIInChI=1S/C13H20N4O.2ClH/c14-6-8-16-13(18)11-5-4-7-15-12(11)17-9-2-1-3-10-17;;/h4-5,7H,1-3,6,8-10,14H2,(H,16,18);2*1H
InChIKeyGDVINKUHWOVYRN-UHFFFAOYSA-N
MW321.25 g/mol
LogP1.60
Rot. Bonds4

About N-(2-aminoethyl)-2-piperidin-1-ylpyridine-3-carboxamide;dihydrochloride

N-(2-aminoethyl)-2-piperidin-1-ylpyridine-3-carboxamide;dihydrochloride (PubChem CID 119383900) has the molecular formula C13H22Cl2N4O and a molecular weight of 321.25 g/mol. Its IUPAC name is N-(2-aminoethyl)-2-piperidin-1-ylpyridine-3-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-(2-aminoethyl)-2-piperidin-1-ylpyridine-3-carboxamide;dihydrochloride
PubChem CID119383900
Molecular FormulaC13H22Cl2N4O
Molecular Weight321.25 g/mol
Exact Mass320.12
IUPAC NameN-(2-aminoethyl)-2-piperidin-1-ylpyridine-3-carboxamide;dihydrochloride
SMILESCl.Cl.NCCNC(=O)c1cccnc1N1CCCCC1
InChIInChI=1S/C13H20N4O.2ClH/c14-6-8-16-13(18)11-5-4-7-15-12(11)17-9-2-1-3-10-17;;/h4-5,7H,1-3,6,8-10,14H2,(H,16,18);2*1H
InChIKeyGDVINKUHWOVYRN-UHFFFAOYSA-N
XLogP1.60
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.25
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 119407815
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CID 119383590
N-ethyl-2-piperidin-1-ylpyridine-3-carboxamide
CID 47231439
N-(2-phenylethyl)-2-pyrrolidin-1-ylpyridine-3-carboxamide
CID 3417086
N-[2-(benzenesulfonyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide
CID 51123416
N-[2-(2,3-dichlorophenyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide
CID 55799150
2-piperidin-1-yl-N-(2-pyrrolidin-3-ylethyl)pyridine-3-carboxamide;dihydrochloride
CID 119535955
N-[2-(3-methylphenyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide
CID 60611627
2-(azepan-1-yl)-N-[(4-methylphenyl)methyl]pyridine-3-carboxamide
CID 84576958
N-[(4-fluorophenyl)methyl]-2-piperidin-1-ylpyridine-3-carboxamide
CID 55755699
N-[2-(2-methoxyphenyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide
CID 55757606
N-[2-[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-piperidin-1-ylpyridine-3-carboxamide
CID 98365172

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2-piperidin-1-ylpyridine-3-carboxamide;dihydrochloride?
The IUPAC name of N-(2-aminoethyl)-2-piperidin-1-ylpyridine-3-carboxamide;dihydrochloride (CID 119383900) is N-(2-aminoethyl)-2-piperidin-1-ylpyridine-3-carboxamide;dihydrochloride.
What is the SMILES notation for N-(2-aminoethyl)-2-piperidin-1-ylpyridine-3-carboxamide;dihydrochloride?
The canonical SMILES for N-(2-aminoethyl)-2-piperidin-1-ylpyridine-3-carboxamide;dihydrochloride is Cl.Cl.NCCNC(=O)c1cccnc1N1CCCCC1.
What is the InChIKey of N-(2-aminoethyl)-2-piperidin-1-ylpyridine-3-carboxamide;dihydrochloride?
The InChIKey is GDVINKUHWOVYRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O.2ClH/c14-6-8-16-13(18)11-5-4-7-15-12(11)17-9-2-1-3-10-17;;/h4-5,7H,1-3,6,8-10,14H2,(H,16,18);2*1H.
What are the key properties of N-(2-aminoethyl)-2-piperidin-1-ylpyridine-3-carboxamide;dihydrochloride?
N-(2-aminoethyl)-2-piperidin-1-ylpyridine-3-carboxamide;dihydrochloride has a molecular weight of 321.25 g/mol, XLogP of 1.60, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-2-piperidin-1-ylpyridine-3-carboxamide;dihydrochloride is sourced from PubChem (CID 119383900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).