7-(6-methylpyridazin-3-yl)-3-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane

C15H23N3O — CID 134077281

IUPAC7-(6-methylpyridazin-3-yl)-3-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane
SMILESCc1ccc(N2CCC3(CC(C(C)C)CO3)C2)nn1
InChIInChI=1S/C15H23N3O/c1-11(2)13-8-15(19-9-13)6-7-18(10-15)14-5-4-12(3)16-17-14/h4-5,11,13H,6-10H2,1-3H3
InChIKeyDCVOXXWXCNRERY-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.43
Rot. Bonds2

About 7-(6-methylpyridazin-3-yl)-3-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane

7-(6-methylpyridazin-3-yl)-3-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane (PubChem CID 134077281) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 7-(6-methylpyridazin-3-yl)-3-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane.

Molecular Properties

Compound Name7-(6-methylpyridazin-3-yl)-3-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane
PubChem CID134077281
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name7-(6-methylpyridazin-3-yl)-3-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane
SMILESCc1ccc(N2CCC3(CC(C(C)C)CO3)C2)nn1
InChIInChI=1S/C15H23N3O/c1-11(2)13-8-15(19-9-13)6-7-18(10-15)14-5-4-12(3)16-17-14/h4-5,11,13H,6-10H2,1-3H3
InChIKeyDCVOXXWXCNRERY-UHFFFAOYSA-N
XLogP2.43
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-[[7-(6-methylpyridazin-3-yl)-1-oxa-7-azaspiro[4.4]nonan-3-yl]oxy]acetamide
CID 134071044
3-[(4-methylpiperazin-1-yl)methyl]-9-(6-methylpyridazin-3-yl)-1-oxa-9-azaspiro[4.5]decane
CID 134072596
4-[(3R,5R)-3-propan-2-yl-1-oxa-7-azaspiro[4.4]nonan-7-yl]benzonitrile
CID 124520491
9-(6-methylpyridazin-3-yl)-3-pyrimidin-2-yloxy-1-oxa-9-azaspiro[4.5]decane
CID 134074991
3-propan-2-yl-7-[4-(trifluoromethyl)pyrimidin-2-yl]-1-oxa-7-azaspiro[4.4]nonane
CID 131661576
3-methyl-6-(4-methylpiperidin-1-yl)pyridazine
CID 59712116
2-methyl-7-propan-2-yl-5-oxa-2-azaspiro[3.4]octane
CID 155238981
3-propan-2-yl-7-(pyridin-2-ylmethyl)-1-oxa-7-azaspiro[4.4]nonane
CID 134070216
(3R)-8-[(5-methylfuran-2-yl)methyl]-3-propan-2-yl-1-oxa-8-azaspiro[4.5]decane
CID 97371264
furan-3-yl-[4-(6-methylpyridazin-3-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]methanone
CID 131903877
(3R,5R)-7-[(1-methylpyrazol-4-yl)methyl]-3-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane
CID 97485296
3-(3-fluoro-4-propan-2-ylpiperidin-1-yl)-6-methylpyridazine
CID 67965093

Frequently Asked Questions

What is the IUPAC name of 7-(6-methylpyridazin-3-yl)-3-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane?
The IUPAC name of 7-(6-methylpyridazin-3-yl)-3-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane (CID 134077281) is 7-(6-methylpyridazin-3-yl)-3-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane.
What is the SMILES notation for 7-(6-methylpyridazin-3-yl)-3-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane?
The canonical SMILES for 7-(6-methylpyridazin-3-yl)-3-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane is Cc1ccc(N2CCC3(CC(C(C)C)CO3)C2)nn1.
What is the InChIKey of 7-(6-methylpyridazin-3-yl)-3-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane?
The InChIKey is DCVOXXWXCNRERY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11(2)13-8-15(19-9-13)6-7-18(10-15)14-5-4-12(3)16-17-14/h4-5,11,13H,6-10H2,1-3H3.
What are the key properties of 7-(6-methylpyridazin-3-yl)-3-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane?
7-(6-methylpyridazin-3-yl)-3-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane has a molecular weight of 261.37 g/mol, XLogP of 2.43, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(6-methylpyridazin-3-yl)-3-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane is sourced from PubChem (CID 134077281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).