11-methyl-2-(6-methylpyridazin-3-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane

C15H24N4O — CID 134072674

IUPAC11-methyl-2-(6-methylpyridazin-3-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane
SMILESCc1ccc(N2CCCC3(COCCN(C)C3)C2)nn1
InChIInChI=1S/C15H24N4O/c1-13-4-5-14(17-16-13)19-7-3-6-15(11-19)10-18(2)8-9-20-12-15/h4-5H,3,6-12H2,1-2H3
InChIKeyMDNPLVDZLBTIIA-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.33
Rot. Bonds1

About 11-methyl-2-(6-methylpyridazin-3-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane

11-methyl-2-(6-methylpyridazin-3-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane (PubChem CID 134072674) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 11-methyl-2-(6-methylpyridazin-3-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane.

Molecular Properties

Compound Name11-methyl-2-(6-methylpyridazin-3-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane
PubChem CID134072674
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name11-methyl-2-(6-methylpyridazin-3-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane
SMILESCc1ccc(N2CCCC3(COCCN(C)C3)C2)nn1
InChIInChI=1S/C15H24N4O/c1-13-4-5-14(17-16-13)19-7-3-6-15(11-19)10-18(2)8-9-20-12-15/h4-5H,3,6-12H2,1-2H3
InChIKeyMDNPLVDZLBTIIA-UHFFFAOYSA-N
XLogP1.33
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(6S)-2-ethylsulfonyl-11-(6-methylpyridazin-3-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane
CID 97494848
2-(6-methylpyridazin-3-yl)-11-(pyridin-2-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane
CID 131640700
(5S)-9-(6-methylpyridazin-3-yl)-2-pyrimidin-2-yl-2,9-diazaspiro[4.5]decane
CID 97484053
(5R)-7-(6-methylpyridazin-3-yl)-2-propyl-2,7-diazaspiro[4.5]decane
CID 97484147
4-[6-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]pyridazin-3-yl]morpholine
CID 155981001
8-(6-methylpyridazin-3-yl)-4-[(5-methylthiophen-2-yl)methyl]-1-oxa-4,8-diazaspiro[5.5]undecane
CID 131660482
3-[(4-methylpiperazin-1-yl)methyl]-9-(6-methylpyridazin-3-yl)-1-oxa-9-azaspiro[4.5]decane
CID 134072596
(6S)-2-(2-methoxyethyl)-8-(6-methylpyridazin-3-yl)-2,8-diazaspiro[5.5]undecan-3-one
CID 96580750
9-(6-methylpyridazin-3-yl)-2,9-diazaspiro[4.5]decan-1-one
CID 131649510
(6S)-8-(6-methylpyridazin-3-yl)-1,8-diazaspiro[5.5]undecan-2-one
CID 97495304
7-(5-chloro-2-pyridinyl)-2-methyl-2,7-diazaspiro[4.5]decane
CID 56749174
[4-(dimethylamino)phenyl]-[9-(6-methylpyridazin-3-yl)-2,9-diazaspiro[4.5]decan-2-yl]methanone
CID 131663457

Frequently Asked Questions

What is the IUPAC name of 11-methyl-2-(6-methylpyridazin-3-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane?
The IUPAC name of 11-methyl-2-(6-methylpyridazin-3-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane (CID 134072674) is 11-methyl-2-(6-methylpyridazin-3-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane.
What is the SMILES notation for 11-methyl-2-(6-methylpyridazin-3-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane?
The canonical SMILES for 11-methyl-2-(6-methylpyridazin-3-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane is Cc1ccc(N2CCCC3(COCCN(C)C3)C2)nn1.
What is the InChIKey of 11-methyl-2-(6-methylpyridazin-3-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane?
The InChIKey is MDNPLVDZLBTIIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-13-4-5-14(17-16-13)19-7-3-6-15(11-19)10-18(2)8-9-20-12-15/h4-5H,3,6-12H2,1-2H3.
What are the key properties of 11-methyl-2-(6-methylpyridazin-3-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane?
11-methyl-2-(6-methylpyridazin-3-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane has a molecular weight of 276.38 g/mol, XLogP of 1.33, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 11-methyl-2-(6-methylpyridazin-3-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane is sourced from PubChem (CID 134072674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).