(3-aminopyrazin-2-yl)-[3-(methylamino)piperidin-1-yl]methanone

C11H17N5O — CID 119487560

IUPAC(3-aminopyrazin-2-yl)-[3-(methylamino)piperidin-1-yl]methanone
SMILESCNC1CCCN(C(=O)c2nccnc2N)C1
InChIInChI=1S/C11H17N5O/c1-13-8-3-2-6-16(7-8)11(17)9-10(12)15-5-4-14-9/h4-5,8,13H,2-3,6-7H2,1H3,(H2,12,15)
InChIKeyFTKCRFUXZDXZGM-UHFFFAOYSA-N
MW235.29 g/mol
LogP-0.12
Rot. Bonds2

About (3-aminopyrazin-2-yl)-[3-(methylamino)piperidin-1-yl]methanone

(3-aminopyrazin-2-yl)-[3-(methylamino)piperidin-1-yl]methanone (PubChem CID 119487560) has the molecular formula C11H17N5O and a molecular weight of 235.29 g/mol. Its IUPAC name is (3-aminopyrazin-2-yl)-[3-(methylamino)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(3-aminopyrazin-2-yl)-[3-(methylamino)piperidin-1-yl]methanone
PubChem CID119487560
Molecular FormulaC11H17N5O
Molecular Weight235.29 g/mol
Exact Mass235.14
IUPAC Name(3-aminopyrazin-2-yl)-[3-(methylamino)piperidin-1-yl]methanone
SMILESCNC1CCCN(C(=O)c2nccnc2N)C1
InChIInChI=1S/C11H17N5O/c1-13-8-3-2-6-16(7-8)11(17)9-10(12)15-5-4-14-9/h4-5,8,13H,2-3,6-7H2,1H3,(H2,12,15)
InChIKeyFTKCRFUXZDXZGM-UHFFFAOYSA-N
XLogP-0.12
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 5-0.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[(3R)-3-(methylamino)piperidin-1-yl]-pyrazin-2-ylmethanone
CID 94475780
(3-aminopyrazin-2-yl)-[3-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]azocan-1-yl]methanone
CID 138007611
2-[[1-(3-aminopyrazine-2-carbonyl)piperidin-3-yl]-methylamino]-N,N-diethylacetamide
CID 167843023
[3-(methylamino)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone
CID 63080160
(5-bromo-1H-indazol-3-yl)-[(3S)-3-(methylamino)piperidin-1-yl]methanone
CID 124612175
(3-aminopyrazin-2-yl)-[3-(2-methylpropoxy)pyrrolidin-1-yl]methanone
CID 119163703
(1-tert-butyl-5-methylpyrazol-4-yl)-[3-(methylamino)piperidin-1-yl]methanone
CID 119487736
[3-(methylamino)piperidin-1-yl]-(2,3,4,5,6-pentafluorophenyl)methanone
CID 62536372
(3-aminopyrazin-2-yl)-[(2R)-2-[(2S)-1-methylpyrrolidin-2-yl]pyrrolidin-1-yl]methanone
CID 129427472
2-(3-acetamidopiperidine-1-carbonyl)pyridine-3-carboxylic acid
CID 63616081
(2R)-1-(3-aminopyrazine-2-carbonyl)pyrrolidine-2-carboxylic acid
CID 119371307
(4-fluorophenyl)-[3-(methylamino)piperidin-1-yl]methanone
CID 62535610

Frequently Asked Questions

What is the IUPAC name of (3-aminopyrazin-2-yl)-[3-(methylamino)piperidin-1-yl]methanone?
The IUPAC name of (3-aminopyrazin-2-yl)-[3-(methylamino)piperidin-1-yl]methanone (CID 119487560) is (3-aminopyrazin-2-yl)-[3-(methylamino)piperidin-1-yl]methanone.
What is the SMILES notation for (3-aminopyrazin-2-yl)-[3-(methylamino)piperidin-1-yl]methanone?
The canonical SMILES for (3-aminopyrazin-2-yl)-[3-(methylamino)piperidin-1-yl]methanone is CNC1CCCN(C(=O)c2nccnc2N)C1.
What is the InChIKey of (3-aminopyrazin-2-yl)-[3-(methylamino)piperidin-1-yl]methanone?
The InChIKey is FTKCRFUXZDXZGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O/c1-13-8-3-2-6-16(7-8)11(17)9-10(12)15-5-4-14-9/h4-5,8,13H,2-3,6-7H2,1H3,(H2,12,15).
What are the key properties of (3-aminopyrazin-2-yl)-[3-(methylamino)piperidin-1-yl]methanone?
(3-aminopyrazin-2-yl)-[3-(methylamino)piperidin-1-yl]methanone has a molecular weight of 235.29 g/mol, XLogP of -0.12, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminopyrazin-2-yl)-[3-(methylamino)piperidin-1-yl]methanone is sourced from PubChem (CID 119487560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).