8-(ethoxymethyl)-5-methyl-2-(thiophen-3-ylmethyl)-2,5-diazaspiro[3.5]nonane

C16H26N2OS — CID 131678334

IUPAC8-(ethoxymethyl)-5-methyl-2-(thiophen-3-ylmethyl)-2,5-diazaspiro[3.5]nonane
SMILESCCOCC1CCN(C)C2(C1)CN(Cc1ccsc1)C2
InChIInChI=1S/C16H26N2OS/c1-3-19-10-14-4-6-17(2)16(8-14)12-18(13-16)9-15-5-7-20-11-15/h5,7,11,14H,3-4,6,8-10,12-13H2,1-2H3
InChIKeyOBFZRFDAPGMJRP-UHFFFAOYSA-N
MW294.46 g/mol
LogP2.68
Rot. Bonds5

About 8-(ethoxymethyl)-5-methyl-2-(thiophen-3-ylmethyl)-2,5-diazaspiro[3.5]nonane

8-(ethoxymethyl)-5-methyl-2-(thiophen-3-ylmethyl)-2,5-diazaspiro[3.5]nonane (PubChem CID 131678334) has the molecular formula C16H26N2OS and a molecular weight of 294.46 g/mol. Its IUPAC name is 8-(ethoxymethyl)-5-methyl-2-(thiophen-3-ylmethyl)-2,5-diazaspiro[3.5]nonane.

Molecular Properties

Compound Name8-(ethoxymethyl)-5-methyl-2-(thiophen-3-ylmethyl)-2,5-diazaspiro[3.5]nonane
PubChem CID131678334
Molecular FormulaC16H26N2OS
Molecular Weight294.46 g/mol
Exact Mass294.18
IUPAC Name8-(ethoxymethyl)-5-methyl-2-(thiophen-3-ylmethyl)-2,5-diazaspiro[3.5]nonane
SMILESCCOCC1CCN(C)C2(C1)CN(Cc1ccsc1)C2
InChIInChI=1S/C16H26N2OS/c1-3-19-10-14-4-6-17(2)16(8-14)12-18(13-16)9-15-5-7-20-11-15/h5,7,11,14H,3-4,6,8-10,12-13H2,1-2H3
InChIKeyOBFZRFDAPGMJRP-UHFFFAOYSA-N
XLogP2.68
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.46
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-8-(pyridin-4-ylmethoxymethyl)-2-(thiophen-3-ylmethyl)-2,5-diazaspiro[3.5]nonane
CID 131678470
2-[(3,5-dimethoxyphenyl)methyl]-8-(ethoxymethyl)-5-methyl-2,5-diazaspiro[3.5]nonane
CID 131677402
2-(1,3-benzodioxol-5-ylmethyl)-8-(ethoxymethyl)-5-methyl-2,5-diazaspiro[3.5]nonane
CID 133142916
5-methyl-8-(pyridin-3-ylmethoxymethyl)-2-(pyridin-3-ylmethyl)-2,5-diazaspiro[3.5]nonane
CID 131644582
4-methyl-2-[[5-methyl-8-(pyridin-4-ylmethoxymethyl)-2,5-diazaspiro[3.5]nonan-2-yl]methyl]-1,3-thiazole
CID 131677507
8-(ethoxymethyl)-5-methyl-2-(2-methylphenyl)sulfonyl-2,5-diazaspiro[3.5]nonane
CID 131677748
(8S)-2-(1,3-benzodioxol-5-ylmethyl)-8-(methoxymethyl)-5-methyl-2,5-diazaspiro[3.5]nonane
CID 124814715
2-(2-chlorophenyl)sulfonyl-8-(ethoxymethyl)-5-methyl-2,5-diazaspiro[3.5]nonane
CID 131677753
[8-(ethoxymethyl)-5-methyl-2,5-diazaspiro[3.5]nonan-2-yl]-pyrazin-2-ylmethanone
CID 131671724
[8-(ethoxymethyl)-5-methyl-2,5-diazaspiro[3.5]nonan-2-yl]-[1-(2-methoxyethyl)pyrazol-3-yl]methanone
CID 131669189
5-methyl-2-(pyridin-3-ylmethyl)-8-(pyridin-2-yloxymethyl)-2,5-diazaspiro[3.5]nonane
CID 131662338
(7S)-7-(ethoxymethyl)-1-methyl-5-(thiophen-3-ylmethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine
CID 97368289

Frequently Asked Questions

What is the IUPAC name of 8-(ethoxymethyl)-5-methyl-2-(thiophen-3-ylmethyl)-2,5-diazaspiro[3.5]nonane?
The IUPAC name of 8-(ethoxymethyl)-5-methyl-2-(thiophen-3-ylmethyl)-2,5-diazaspiro[3.5]nonane (CID 131678334) is 8-(ethoxymethyl)-5-methyl-2-(thiophen-3-ylmethyl)-2,5-diazaspiro[3.5]nonane.
What is the SMILES notation for 8-(ethoxymethyl)-5-methyl-2-(thiophen-3-ylmethyl)-2,5-diazaspiro[3.5]nonane?
The canonical SMILES for 8-(ethoxymethyl)-5-methyl-2-(thiophen-3-ylmethyl)-2,5-diazaspiro[3.5]nonane is CCOCC1CCN(C)C2(C1)CN(Cc1ccsc1)C2.
What is the InChIKey of 8-(ethoxymethyl)-5-methyl-2-(thiophen-3-ylmethyl)-2,5-diazaspiro[3.5]nonane?
The InChIKey is OBFZRFDAPGMJRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2OS/c1-3-19-10-14-4-6-17(2)16(8-14)12-18(13-16)9-15-5-7-20-11-15/h5,7,11,14H,3-4,6,8-10,12-13H2,1-2H3.
What are the key properties of 8-(ethoxymethyl)-5-methyl-2-(thiophen-3-ylmethyl)-2,5-diazaspiro[3.5]nonane?
8-(ethoxymethyl)-5-methyl-2-(thiophen-3-ylmethyl)-2,5-diazaspiro[3.5]nonane has a molecular weight of 294.46 g/mol, XLogP of 2.68, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(ethoxymethyl)-5-methyl-2-(thiophen-3-ylmethyl)-2,5-diazaspiro[3.5]nonane is sourced from PubChem (CID 131678334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).