2-[4-(6-aminopyridine-3-carbonyl)piperazin-1-yl]-N-ethylacetamide

C14H21N5O2 — CID 72857433

IUPAC2-[4-(6-aminopyridine-3-carbonyl)piperazin-1-yl]-N-ethylacetamide
SMILESCCNC(=O)CN1CCN(C(=O)c2ccc(N)nc2)CC1
InChIInChI=1S/C14H21N5O2/c1-2-16-13(20)10-18-5-7-19(8-6-18)14(21)11-3-4-12(15)17-9-11/h3-4,9H,2,5-8,10H2,1H3,(H2,15,17)(H,16,20)
InChIKeyWEEOBSCYXVHZLU-UHFFFAOYSA-N
MW291.36 g/mol
LogP-0.44
Rot. Bonds4

About 2-[4-(6-aminopyridine-3-carbonyl)piperazin-1-yl]-N-ethylacetamide

2-[4-(6-aminopyridine-3-carbonyl)piperazin-1-yl]-N-ethylacetamide (PubChem CID 72857433) has the molecular formula C14H21N5O2 and a molecular weight of 291.36 g/mol. Its IUPAC name is 2-[4-(6-aminopyridine-3-carbonyl)piperazin-1-yl]-N-ethylacetamide.

Molecular Properties

Compound Name2-[4-(6-aminopyridine-3-carbonyl)piperazin-1-yl]-N-ethylacetamide
PubChem CID72857433
Molecular FormulaC14H21N5O2
Molecular Weight291.36 g/mol
Exact Mass291.17
IUPAC Name2-[4-(6-aminopyridine-3-carbonyl)piperazin-1-yl]-N-ethylacetamide
SMILESCCNC(=O)CN1CCN(C(=O)c2ccc(N)nc2)CC1
InChIInChI=1S/C14H21N5O2/c1-2-16-13(20)10-18-5-7-19(8-6-18)14(21)11-3-4-12(15)17-9-11/h3-4,9H,2,5-8,10H2,1H3,(H2,15,17)(H,16,20)
InChIKeyWEEOBSCYXVHZLU-UHFFFAOYSA-N
XLogP-0.44
TPSA91.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.36
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(4-aminobenzoyl)piperazin-1-yl]-N-ethylacetamide;dihydrochloride
CID 119843977
4-(6-aminopyridine-3-carbonyl)piperazine-1-carboxylic acid
CID 86641079
6-amino-N-[3-(ethylamino)-3-oxopropyl]pyridine-3-carboxamide
CID 113411051
6-amino-N-ethylpyridine-3-carboxamide
CID 62073744
2-[4-[2-(3-aminopyrazol-1-yl)acetyl]piperazin-1-yl]-N-ethylacetamide
CID 62113895
(6-amino-3-pyridinyl)-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperazin-1-yl]methanone
CID 140876648
N-methyl-2-[4-[6-(trifluoromethyl)pyridine-3-carbonyl]piperazin-1-yl]acetamide
CID 134025795
N-cyclopropyl-2-[4-(6-methylpyridine-3-carbonyl)piperazin-1-yl]acetamide
CID 43045355
2-[4-[4-(cyclopropylcarbamoylamino)benzoyl]piperazin-1-yl]-N-ethylacetamide
CID 55829505
N-ethyl-2-[4-(2-methylsulfanylpyridine-3-carbonyl)piperazin-1-yl]acetamide
CID 46448693
N-butan-2-yl-2-[4-(6-methoxypyridine-3-carbonyl)piperazin-1-yl]acetamide
CID 134043905
2-[4-(6-methylpyridine-3-carbonyl)piperazin-1-yl]ethanethioamide
CID 55203104

Frequently Asked Questions

What is the IUPAC name of 2-[4-(6-aminopyridine-3-carbonyl)piperazin-1-yl]-N-ethylacetamide?
The IUPAC name of 2-[4-(6-aminopyridine-3-carbonyl)piperazin-1-yl]-N-ethylacetamide (CID 72857433) is 2-[4-(6-aminopyridine-3-carbonyl)piperazin-1-yl]-N-ethylacetamide.
What is the SMILES notation for 2-[4-(6-aminopyridine-3-carbonyl)piperazin-1-yl]-N-ethylacetamide?
The canonical SMILES for 2-[4-(6-aminopyridine-3-carbonyl)piperazin-1-yl]-N-ethylacetamide is CCNC(=O)CN1CCN(C(=O)c2ccc(N)nc2)CC1.
What is the InChIKey of 2-[4-(6-aminopyridine-3-carbonyl)piperazin-1-yl]-N-ethylacetamide?
The InChIKey is WEEOBSCYXVHZLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O2/c1-2-16-13(20)10-18-5-7-19(8-6-18)14(21)11-3-4-12(15)17-9-11/h3-4,9H,2,5-8,10H2,1H3,(H2,15,17)(H,16,20).
What are the key properties of 2-[4-(6-aminopyridine-3-carbonyl)piperazin-1-yl]-N-ethylacetamide?
2-[4-(6-aminopyridine-3-carbonyl)piperazin-1-yl]-N-ethylacetamide has a molecular weight of 291.36 g/mol, XLogP of -0.44, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(6-aminopyridine-3-carbonyl)piperazin-1-yl]-N-ethylacetamide is sourced from PubChem (CID 72857433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).