[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]-pyridin-2-ylmethanone

C16H19N5O2 — CID 53185554

IUPAC[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]-pyridin-2-ylmethanone
SMILESCOc1nccnc1NC1CCN(C(=O)c2ccccn2)CC1
InChIInChI=1S/C16H19N5O2/c1-23-15-14(18-8-9-19-15)20-12-5-10-21(11-6-12)16(22)13-4-2-3-7-17-13/h2-4,7-9,12H,5-6,10-11H2,1H3,(H,18,20)
InChIKeyVUBYAUAXDICLJG-UHFFFAOYSA-N
MW313.36 g/mol
LogP1.60
Rot. Bonds4

About [4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]-pyridin-2-ylmethanone

[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]-pyridin-2-ylmethanone (PubChem CID 53185554) has the molecular formula C16H19N5O2 and a molecular weight of 313.36 g/mol. Its IUPAC name is [4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]-pyridin-2-ylmethanone.

Molecular Properties

Compound Name[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]-pyridin-2-ylmethanone
PubChem CID53185554
Molecular FormulaC16H19N5O2
Molecular Weight313.36 g/mol
Exact Mass313.15
IUPAC Name[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]-pyridin-2-ylmethanone
SMILESCOc1nccnc1NC1CCN(C(=O)c2ccccn2)CC1
InChIInChI=1S/C16H19N5O2/c1-23-15-14(18-8-9-19-15)20-12-5-10-21(11-6-12)16(22)13-4-2-3-7-17-13/h2-4,7-9,12H,5-6,10-11H2,1H3,(H,18,20)
InChIKeyVUBYAUAXDICLJG-UHFFFAOYSA-N
XLogP1.60
TPSA80.24 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]-pyridin-2-ylmethanone with MolForge

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Related Compounds

1H-indol-3-yl-[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]methanone
CID 53185539
1-[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]-3-phenylpropan-1-one
CID 53185557
[4-[(3-ethoxypyrazin-2-yl)amino]piperidin-1-yl]-phenylmethanone
CID 87053000
[3-[(3-chloro-2-pyridinyl)amino]pyrrolidin-1-yl]-pyridin-2-ylmethanone
CID 133404509
3-methoxy-N-[1-(pyridine-2-carbonyl)piperidin-4-yl]benzamide
CID 47029925
[3-[(4-methyl-3-nitro-2-pyridinyl)amino]pyrrolidin-1-yl]-pyridin-2-ylmethanone
CID 133367516
4-oxo-N-[1-(pyridine-2-carbonyl)piperidin-4-yl]pentanamide
CID 108558110
2-fluoro-N-[1-(pyridine-2-carbonyl)piperidin-4-yl]benzamide
CID 110821143
1-[4-[4-(pyridine-2-carbonyl)piperazine-1-carbonyl]piperidin-1-yl]ethanone
CID 110814030
4-[[3-(pyridine-2-carbonylamino)-2-pyridinyl]amino]piperidine-1-carboxylic acid
CID 71120257
furan-3-yl-[4-[(3-propoxypyrazin-2-yl)amino]piperidin-1-yl]methanone
CID 87053011
methyl (3S,4S)-3-methyl-1-(pyridine-2-carbonyl)piperidine-4-carboxylate
CID 99834690

Frequently Asked Questions

What is the IUPAC name of [4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]-pyridin-2-ylmethanone?
The IUPAC name of [4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]-pyridin-2-ylmethanone (CID 53185554) is [4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]-pyridin-2-ylmethanone.
What is the SMILES notation for [4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]-pyridin-2-ylmethanone?
The canonical SMILES for [4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]-pyridin-2-ylmethanone is COc1nccnc1NC1CCN(C(=O)c2ccccn2)CC1.
What is the InChIKey of [4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]-pyridin-2-ylmethanone?
The InChIKey is VUBYAUAXDICLJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O2/c1-23-15-14(18-8-9-19-15)20-12-5-10-21(11-6-12)16(22)13-4-2-3-7-17-13/h2-4,7-9,12H,5-6,10-11H2,1H3,(H,18,20).
What are the key properties of [4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]-pyridin-2-ylmethanone?
[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]-pyridin-2-ylmethanone has a molecular weight of 313.36 g/mol, XLogP of 1.60, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]-pyridin-2-ylmethanone is sourced from PubChem (CID 53185554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).