2-[[1-(3-aminopyrazine-2-carbonyl)piperidin-3-yl]-methylamino]-N,N-diethylacetamide

C17H28N6O2 — CID 167843023

IUPAC2-[[1-(3-aminopyrazine-2-carbonyl)piperidin-3-yl]-methylamino]-N,N-diethylacetamide
SMILESCCN(CC)C(=O)CN(C)C1CCCN(C(=O)c2nccnc2N)C1
InChIInChI=1S/C17H28N6O2/c1-4-22(5-2)14(24)12-21(3)13-7-6-10-23(11-13)17(25)15-16(18)20-9-8-19-15/h8-9,13H,4-7,10-12H2,1-3H3,(H2,18,20)
InChIKeyUIWPDFKBLUMXJH-UHFFFAOYSA-N
MW348.45 g/mol
LogP0.46
Rot. Bonds6

About 2-[[1-(3-aminopyrazine-2-carbonyl)piperidin-3-yl]-methylamino]-N,N-diethylacetamide

2-[[1-(3-aminopyrazine-2-carbonyl)piperidin-3-yl]-methylamino]-N,N-diethylacetamide (PubChem CID 167843023) has the molecular formula C17H28N6O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is 2-[[1-(3-aminopyrazine-2-carbonyl)piperidin-3-yl]-methylamino]-N,N-diethylacetamide.

Molecular Properties

Compound Name2-[[1-(3-aminopyrazine-2-carbonyl)piperidin-3-yl]-methylamino]-N,N-diethylacetamide
PubChem CID167843023
Molecular FormulaC17H28N6O2
Molecular Weight348.45 g/mol
Exact Mass348.23
IUPAC Name2-[[1-(3-aminopyrazine-2-carbonyl)piperidin-3-yl]-methylamino]-N,N-diethylacetamide
SMILESCCN(CC)C(=O)CN(C)C1CCCN(C(=O)c2nccnc2N)C1
InChIInChI=1S/C17H28N6O2/c1-4-22(5-2)14(24)12-21(3)13-7-6-10-23(11-13)17(25)15-16(18)20-9-8-19-15/h8-9,13H,4-7,10-12H2,1-3H3,(H2,18,20)
InChIKeyUIWPDFKBLUMXJH-UHFFFAOYSA-N
XLogP0.46
TPSA95.66 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[[1-(3-aminopyrazine-2-carbonyl)piperidin-3-yl]-methylamino]-N,N-diethylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3-aminopyrazin-2-yl)-[3-(methylamino)piperidin-1-yl]methanone
CID 119487560
(3-aminopyrazin-2-yl)-[3-(2-methylpropoxy)pyrrolidin-1-yl]methanone
CID 119163703
(3-amino-2-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone
CID 104742285
(3-aminopyrazin-2-yl)-[3-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]azocan-1-yl]methanone
CID 138007611
isoquinolin-1-yl-[(3S)-3-[methyl(2-phenylethyl)amino]piperidin-1-yl]methanone
CID 25296938
3-[(3S)-1-(3-aminopyrazine-2-carbonyl)piperidin-3-yl]-N-ethyl-1-phenylpyrazole-4-carboxamide
CID 129323530
3-amino-N,N-diethylpyrazine-2-carboxamide
CID 13141221
tert-butyl 3-[methyl-(2-oxo-2-pyrazin-2-ylethyl)amino]piperidine-1-carboxylate
CID 71647334
[3-(N-methylanilino)pyrrolidin-1-yl]-(3-methylpyrazin-2-yl)methanone
CID 167886981
[3-[2-(dimethylamino)ethyl-methylamino]piperidin-1-yl]-(2-propylpyrazol-3-yl)methanone
CID 56899449
[(4R,4aR,8aR)-4-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-(3-aminopyrazin-2-yl)methanone
CID 97092506
(3-aminopyrazin-2-yl)-[4-(4-fluorophenoxy)piperidin-1-yl]methanone
CID 119133482

Frequently Asked Questions

What is the IUPAC name of 2-[[1-(3-aminopyrazine-2-carbonyl)piperidin-3-yl]-methylamino]-N,N-diethylacetamide?
The IUPAC name of 2-[[1-(3-aminopyrazine-2-carbonyl)piperidin-3-yl]-methylamino]-N,N-diethylacetamide (CID 167843023) is 2-[[1-(3-aminopyrazine-2-carbonyl)piperidin-3-yl]-methylamino]-N,N-diethylacetamide.
What is the SMILES notation for 2-[[1-(3-aminopyrazine-2-carbonyl)piperidin-3-yl]-methylamino]-N,N-diethylacetamide?
The canonical SMILES for 2-[[1-(3-aminopyrazine-2-carbonyl)piperidin-3-yl]-methylamino]-N,N-diethylacetamide is CCN(CC)C(=O)CN(C)C1CCCN(C(=O)c2nccnc2N)C1.
What is the InChIKey of 2-[[1-(3-aminopyrazine-2-carbonyl)piperidin-3-yl]-methylamino]-N,N-diethylacetamide?
The InChIKey is UIWPDFKBLUMXJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N6O2/c1-4-22(5-2)14(24)12-21(3)13-7-6-10-23(11-13)17(25)15-16(18)20-9-8-19-15/h8-9,13H,4-7,10-12H2,1-3H3,(H2,18,20).
What are the key properties of 2-[[1-(3-aminopyrazine-2-carbonyl)piperidin-3-yl]-methylamino]-N,N-diethylacetamide?
2-[[1-(3-aminopyrazine-2-carbonyl)piperidin-3-yl]-methylamino]-N,N-diethylacetamide has a molecular weight of 348.45 g/mol, XLogP of 0.46, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-(3-aminopyrazine-2-carbonyl)piperidin-3-yl]-methylamino]-N,N-diethylacetamide is sourced from PubChem (CID 167843023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).