8-methyl-9-(thiophen-3-ylmethyl)-6,9-diazaspiro[4.5]decane

C14H22N2S — CID 64876781

IUPAC8-methyl-9-(thiophen-3-ylmethyl)-6,9-diazaspiro[4.5]decane
SMILESCC1CNC2(CCCC2)CN1Cc1ccsc1
InChIInChI=1S/C14H22N2S/c1-12-8-15-14(5-2-3-6-14)11-16(12)9-13-4-7-17-10-13/h4,7,10,12,15H,2-3,5-6,8-9,11H2,1H3
InChIKeyWBIYDSUOMLTBRJ-UHFFFAOYSA-N
MW250.41 g/mol
LogP2.85
Rot. Bonds2

About 8-methyl-9-(thiophen-3-ylmethyl)-6,9-diazaspiro[4.5]decane

8-methyl-9-(thiophen-3-ylmethyl)-6,9-diazaspiro[4.5]decane (PubChem CID 64876781) has the molecular formula C14H22N2S and a molecular weight of 250.41 g/mol. Its IUPAC name is 8-methyl-9-(thiophen-3-ylmethyl)-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8-methyl-9-(thiophen-3-ylmethyl)-6,9-diazaspiro[4.5]decane
PubChem CID64876781
Molecular FormulaC14H22N2S
Molecular Weight250.41 g/mol
Exact Mass250.15
IUPAC Name8-methyl-9-(thiophen-3-ylmethyl)-6,9-diazaspiro[4.5]decane
SMILESCC1CNC2(CCCC2)CN1Cc1ccsc1
InChIInChI=1S/C14H22N2S/c1-12-8-15-14(5-2-3-6-14)11-16(12)9-13-4-7-17-10-13/h4,7,10,12,15H,2-3,5-6,8-9,11H2,1H3
InChIKeyWBIYDSUOMLTBRJ-UHFFFAOYSA-N
XLogP2.85
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.41
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dimethyl-5-phenyl-1-(thiophen-3-ylmethyl)piperazine
CID 64862285
8-(2-methylpropyl)-9-(2-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane
CID 64876228
8-butan-2-yl-9-(2-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane
CID 64877949
9-[(2,3-difluorophenyl)methyl]-8-methyl-6,9-diazaspiro[4.5]decane
CID 64877544
(2S)-2-methyl-1-(thiophen-3-ylmethyl)piperazine
CID 82755314
4-[(2,3-difluorophenyl)methyl]-3-methyl-1,4-diazaspiro[5.5]undecane
CID 64876835
4-methyl-2-[(8-methyl-6,9-diazaspiro[4.5]decan-9-yl)methyl]-1,3-thiazole
CID 64945713
3-methyl-4-[(2-methylphenyl)methyl]-1,4-diazaspiro[5.5]undecane
CID 64877988
2-methyl-4-[(3-methyl-1,4-diazaspiro[5.5]undecan-4-yl)methyl]-1,3-thiazole
CID 64948404
8-methyl-9-[(1-methylpyrazol-3-yl)methyl]-6,9-diazaspiro[4.5]decane
CID 82871467
9-[(4,5-dimethylthiophen-2-yl)methyl]-8-methyl-6,9-diazaspiro[4.5]decane
CID 65245286
9-ethyl-8-methyl-6,9-diazaspiro[4.5]decane
CID 64877161

Frequently Asked Questions

What is the IUPAC name of 8-methyl-9-(thiophen-3-ylmethyl)-6,9-diazaspiro[4.5]decane?
The IUPAC name of 8-methyl-9-(thiophen-3-ylmethyl)-6,9-diazaspiro[4.5]decane (CID 64876781) is 8-methyl-9-(thiophen-3-ylmethyl)-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 8-methyl-9-(thiophen-3-ylmethyl)-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 8-methyl-9-(thiophen-3-ylmethyl)-6,9-diazaspiro[4.5]decane is CC1CNC2(CCCC2)CN1Cc1ccsc1.
What is the InChIKey of 8-methyl-9-(thiophen-3-ylmethyl)-6,9-diazaspiro[4.5]decane?
The InChIKey is WBIYDSUOMLTBRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2S/c1-12-8-15-14(5-2-3-6-14)11-16(12)9-13-4-7-17-10-13/h4,7,10,12,15H,2-3,5-6,8-9,11H2,1H3.
What are the key properties of 8-methyl-9-(thiophen-3-ylmethyl)-6,9-diazaspiro[4.5]decane?
8-methyl-9-(thiophen-3-ylmethyl)-6,9-diazaspiro[4.5]decane has a molecular weight of 250.41 g/mol, XLogP of 2.85, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-9-(thiophen-3-ylmethyl)-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 64876781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).