8-(2-methyl-3-propyl-4-pyridinyl)-2-oxa-5,8-diazaspiro[3.5]nonane

C15H23N3O — CID 177040445

IUPAC8-(2-methyl-3-propyl-4-pyridinyl)-2-oxa-5,8-diazaspiro[3.5]nonane
SMILESCCCc1c(N2CCNC3(COC3)C2)ccnc1C
InChIInChI=1S/C15H23N3O/c1-3-4-13-12(2)16-6-5-14(13)18-8-7-17-15(9-18)10-19-11-15/h5-6,17H,3-4,7-11H2,1-2H3
InChIKeySBCLCZCMEICDNH-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.52
Rot. Bonds3

About 8-(2-methyl-3-propyl-4-pyridinyl)-2-oxa-5,8-diazaspiro[3.5]nonane

8-(2-methyl-3-propyl-4-pyridinyl)-2-oxa-5,8-diazaspiro[3.5]nonane (PubChem CID 177040445) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 8-(2-methyl-3-propyl-4-pyridinyl)-2-oxa-5,8-diazaspiro[3.5]nonane.

Molecular Properties

Compound Name8-(2-methyl-3-propyl-4-pyridinyl)-2-oxa-5,8-diazaspiro[3.5]nonane
PubChem CID177040445
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name8-(2-methyl-3-propyl-4-pyridinyl)-2-oxa-5,8-diazaspiro[3.5]nonane
SMILESCCCc1c(N2CCNC3(COC3)C2)ccnc1C
InChIInChI=1S/C15H23N3O/c1-3-4-13-12(2)16-6-5-14(13)18-8-7-17-15(9-18)10-19-11-15/h5-6,17H,3-4,7-11H2,1-2H3
InChIKeySBCLCZCMEICDNH-UHFFFAOYSA-N
XLogP1.52
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

butanal;ethane;7-(2-methyl-3-propyl-4-pyridinyl)-4,7-diazaspiro[2.5]octane
CID 177040837
ethane;7-(2-methyl-3-propyl-4-pyridinyl)-4,7-diazaspiro[2.5]octane;pentan-2-one
CID 177041228
3,3-dimethyl-1-(2-methyl-3-propyl-4-pyridinyl)piperazine;2,6-dimethyl-5-propylpyrazolo[3,4-b]pyridine;pentan-2-one
CID 177040595
3,3-dimethyl-1-(2-methyl-3-propyl-4-pyridinyl)piperazine;ethane;7-fluoro-2-methyl-6-propylimidazo[1,2-a]pyridine;pentan-2-one
CID 177040757
2-methyl-4-[(3R)-3-methylpyrrolidin-1-yl]-3-propylpyridine;pentan-2-one
CID 177040578
2,4-dimethyl-3-propylpyridine
CID 14197863
1-[4-(4,7-diazaspiro[2.5]octan-7-yl)-2,3-dihydropyrrolo[2,3-b]pyridin-1-yl]ethanone
CID 177040248
butanoyl fluoride;7-fluoro-2-methylimidazo[1,2-a]pyridine;methoxymethane;1-(2-methyl-3-propyl-4-pyridinyl)piperazine
CID 177040895
1-[4-(4,7-diazaspiro[2.5]octan-7-yl)-2,3-dihydropyrrolo[2,3-b]pyridin-1-yl]ethanone;methane
CID 177040247
1-[2-methyl-3-propyl-6-(trifluoromethyl)-4-pyridinyl]piperazine
CID 177040771
N-[6-[(Z)-2-aminoprop-1-enyl]-3-methoxypyridazin-4-yl]butanamide;3-methyl-1-(2-methyl-3-propyl-4-pyridinyl)piperazine
CID 177040477
1-[4-(3,3-dimethylpiperazin-1-yl)-3-propyl-2-pyridinyl]-9-(7-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)nonan-5-one;molecular hydrogen
CID 177040016

Frequently Asked Questions

What is the IUPAC name of 8-(2-methyl-3-propyl-4-pyridinyl)-2-oxa-5,8-diazaspiro[3.5]nonane?
The IUPAC name of 8-(2-methyl-3-propyl-4-pyridinyl)-2-oxa-5,8-diazaspiro[3.5]nonane (CID 177040445) is 8-(2-methyl-3-propyl-4-pyridinyl)-2-oxa-5,8-diazaspiro[3.5]nonane.
What is the SMILES notation for 8-(2-methyl-3-propyl-4-pyridinyl)-2-oxa-5,8-diazaspiro[3.5]nonane?
The canonical SMILES for 8-(2-methyl-3-propyl-4-pyridinyl)-2-oxa-5,8-diazaspiro[3.5]nonane is CCCc1c(N2CCNC3(COC3)C2)ccnc1C.
What is the InChIKey of 8-(2-methyl-3-propyl-4-pyridinyl)-2-oxa-5,8-diazaspiro[3.5]nonane?
The InChIKey is SBCLCZCMEICDNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-3-4-13-12(2)16-6-5-14(13)18-8-7-17-15(9-18)10-19-11-15/h5-6,17H,3-4,7-11H2,1-2H3.
What are the key properties of 8-(2-methyl-3-propyl-4-pyridinyl)-2-oxa-5,8-diazaspiro[3.5]nonane?
8-(2-methyl-3-propyl-4-pyridinyl)-2-oxa-5,8-diazaspiro[3.5]nonane has a molecular weight of 261.37 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-methyl-3-propyl-4-pyridinyl)-2-oxa-5,8-diazaspiro[3.5]nonane is sourced from PubChem (CID 177040445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).