[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-3-yl)methanone

C15H22N4O2 — CID 56778602

IUPAC[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-3-yl)methanone
SMILESCc1ccc(NC2CCN(C(=O)C3CCOC3)CC2)nn1
InChIInChI=1S/C15H22N4O2/c1-11-2-3-14(18-17-11)16-13-4-7-19(8-5-13)15(20)12-6-9-21-10-12/h2-3,12-13H,4-10H2,1H3,(H,16,18)
InChIKeyBNCZUOVWGFYINM-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.22
Rot. Bonds3

About [4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-3-yl)methanone

[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-3-yl)methanone (PubChem CID 56778602) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is [4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-3-yl)methanone.

Molecular Properties

Compound Name[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-3-yl)methanone
PubChem CID56778602
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-3-yl)methanone
SMILESCc1ccc(NC2CCN(C(=O)C3CCOC3)CC2)nn1
InChIInChI=1S/C15H22N4O2/c1-11-2-3-14(18-17-11)16-13-4-7-19(8-5-13)15(20)12-6-9-21-10-12/h2-3,12-13H,4-10H2,1H3,(H,16,18)
InChIKeyBNCZUOVWGFYINM-UHFFFAOYSA-N
XLogP1.22
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-2-yl)methanone
CID 56778579
[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-pyridin-4-ylmethanone
CID 56778575
[(3R)-3-(6-methylpyridazin-3-yl)oxypyrrolidin-1-yl]-[(3R)-oxolan-3-yl]methanone
CID 100628592
(5-methylpyrazin-2-yl)-[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]methanone
CID 56778576
[4-[(6-methylpyrimidin-4-yl)amino]piperidin-1-yl]-(oxan-4-yl)methanone
CID 126887514
[4-[2-(6-methylpyridazin-3-yl)oxyethyl]piperazin-1-yl]-(oxolan-3-yl)methanone
CID 126861712
[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(1H-pyrazol-5-yl)methanone
CID 56778589
[4-[6-[(4-methyl-2-pyridinyl)amino]pyridazin-3-yl]piperazin-1-yl]-(oxolan-3-yl)methanone
CID 122346913
2-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]ethanone
CID 56778583
cyclohexyl-[4-[[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]amino]piperidin-1-yl]methanone
CID 133291151
N-[3-[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-3-oxopropyl]methanesulfonamide
CID 56802128
[(3R)-3-(methylamino)pyrrolidin-1-yl]-(oxolan-3-yl)methanone;hydrochloride
CID 172646277

Frequently Asked Questions

What is the IUPAC name of [4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-3-yl)methanone?
The IUPAC name of [4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-3-yl)methanone (CID 56778602) is [4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-3-yl)methanone.
What is the SMILES notation for [4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-3-yl)methanone?
The canonical SMILES for [4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-3-yl)methanone is Cc1ccc(NC2CCN(C(=O)C3CCOC3)CC2)nn1.
What is the InChIKey of [4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-3-yl)methanone?
The InChIKey is BNCZUOVWGFYINM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-11-2-3-14(18-17-11)16-13-4-7-19(8-5-13)15(20)12-6-9-21-10-12/h2-3,12-13H,4-10H2,1H3,(H,16,18).
What are the key properties of [4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-3-yl)methanone?
[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-3-yl)methanone has a molecular weight of 290.37 g/mol, XLogP of 1.22, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-3-yl)methanone is sourced from PubChem (CID 56778602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).