5-(2,7-diazaspiro[4.5]decan-7-ylmethyl)-2,4-dimethyl-1,3-thiazole

C14H23N3S — CID 122558697

IUPAC5-(2,7-diazaspiro[4.5]decan-7-ylmethyl)-2,4-dimethyl-1,3-thiazole
SMILESCc1nc(C)c(CN2CCCC3(CCNC3)C2)s1
InChIInChI=1S/C14H23N3S/c1-11-13(18-12(2)16-11)8-17-7-3-4-14(10-17)5-6-15-9-14/h15H,3-10H2,1-2H3
InChIKeyLOBKGGTXGHNBSC-UHFFFAOYSA-N
MW265.43 g/mol
LogP2.34
Rot. Bonds2

About 5-(2,7-diazaspiro[4.5]decan-7-ylmethyl)-2,4-dimethyl-1,3-thiazole

5-(2,7-diazaspiro[4.5]decan-7-ylmethyl)-2,4-dimethyl-1,3-thiazole (PubChem CID 122558697) has the molecular formula C14H23N3S and a molecular weight of 265.43 g/mol. Its IUPAC name is 5-(2,7-diazaspiro[4.5]decan-7-ylmethyl)-2,4-dimethyl-1,3-thiazole.

Molecular Properties

Compound Name5-(2,7-diazaspiro[4.5]decan-7-ylmethyl)-2,4-dimethyl-1,3-thiazole
PubChem CID122558697
Molecular FormulaC14H23N3S
Molecular Weight265.43 g/mol
Exact Mass265.16
IUPAC Name5-(2,7-diazaspiro[4.5]decan-7-ylmethyl)-2,4-dimethyl-1,3-thiazole
SMILESCc1nc(C)c(CN2CCCC3(CCNC3)C2)s1
InChIInChI=1S/C14H23N3S/c1-11-13(18-12(2)16-11)8-17-7-3-4-14(10-17)5-6-15-9-14/h15H,3-10H2,1-2H3
InChIKeyLOBKGGTXGHNBSC-UHFFFAOYSA-N
XLogP2.34
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.43
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2,7-diazaspiro[4.4]nonan-2-ylmethyl)-2,4-dimethyl-1,3-thiazole;hydrochloride
CID 120908014
1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-3-methylpiperidine-3-carbonitrile
CID 131925287
7-[(2,3,4,5,6-pentafluorophenyl)methyl]-2,7-diazaspiro[4.5]decane
CID 56752325
2-[(2,5-dimethylthiophen-3-yl)methyl]-2,8-diazaspiro[5.5]undecane
CID 102849258
2-(2-amino-4-methyl-1,3-thiazol-5-yl)-1-[(5R)-2,7-diazaspiro[4.5]decan-7-yl]ethanone
CID 95216869
5-[2-(2,8-diazaspiro[5.5]undecan-2-yl)ethyl]-4-methyl-1,3-thiazole
CID 102850296
2-[(2,4,6-trimethylphenyl)methyl]-2,8-diazaspiro[5.5]undecane
CID 102849325
2-(2,8-diazaspiro[5.5]undecan-2-ylmethyl)-1,3-benzothiazole
CID 102850087
6-(2,8-diazaspiro[5.5]undecan-2-ylmethyl)imidazo[2,1-b][1,3]thiazole
CID 102850313
5-(2,8-diazaspiro[5.5]undecan-2-ylmethyl)-3-propan-2-yl-1,2,4-oxadiazole
CID 102850060
(5R)-7-[(3,4-difluorophenyl)methyl]-2,7-diazaspiro[4.5]decane
CID 95724567
2-[(5-methyl-2-pyridinyl)methyl]-2,7-diazaspiro[4.4]nonane
CID 120908225

Frequently Asked Questions

What is the IUPAC name of 5-(2,7-diazaspiro[4.5]decan-7-ylmethyl)-2,4-dimethyl-1,3-thiazole?
The IUPAC name of 5-(2,7-diazaspiro[4.5]decan-7-ylmethyl)-2,4-dimethyl-1,3-thiazole (CID 122558697) is 5-(2,7-diazaspiro[4.5]decan-7-ylmethyl)-2,4-dimethyl-1,3-thiazole.
What is the SMILES notation for 5-(2,7-diazaspiro[4.5]decan-7-ylmethyl)-2,4-dimethyl-1,3-thiazole?
The canonical SMILES for 5-(2,7-diazaspiro[4.5]decan-7-ylmethyl)-2,4-dimethyl-1,3-thiazole is Cc1nc(C)c(CN2CCCC3(CCNC3)C2)s1.
What is the InChIKey of 5-(2,7-diazaspiro[4.5]decan-7-ylmethyl)-2,4-dimethyl-1,3-thiazole?
The InChIKey is LOBKGGTXGHNBSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3S/c1-11-13(18-12(2)16-11)8-17-7-3-4-14(10-17)5-6-15-9-14/h15H,3-10H2,1-2H3.
What are the key properties of 5-(2,7-diazaspiro[4.5]decan-7-ylmethyl)-2,4-dimethyl-1,3-thiazole?
5-(2,7-diazaspiro[4.5]decan-7-ylmethyl)-2,4-dimethyl-1,3-thiazole has a molecular weight of 265.43 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,7-diazaspiro[4.5]decan-7-ylmethyl)-2,4-dimethyl-1,3-thiazole is sourced from PubChem (CID 122558697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).