2-methyl-4-[2-(10-propan-2-yl-3-azaspiro[5.5]undecan-3-yl)ethyl]-1,3-thiazole

C19H32N2S — CID 155632192

IUPAC2-methyl-4-[2-(10-propan-2-yl-3-azaspiro[5.5]undecan-3-yl)ethyl]-1,3-thiazole
SMILESCc1nc(CCN2CCC3(CCCC(C(C)C)C3)CC2)cs1
InChIInChI=1S/C19H32N2S/c1-15(2)17-5-4-7-19(13-17)8-11-21(12-9-19)10-6-18-14-22-16(3)20-18/h14-15,17H,4-13H2,1-3H3
InChIKeyYXUSPVSPRCMDFF-UHFFFAOYSA-N
MW320.55 g/mol
LogP4.92
Rot. Bonds4

About 2-methyl-4-[2-(10-propan-2-yl-3-azaspiro[5.5]undecan-3-yl)ethyl]-1,3-thiazole

2-methyl-4-[2-(10-propan-2-yl-3-azaspiro[5.5]undecan-3-yl)ethyl]-1,3-thiazole (PubChem CID 155632192) has the molecular formula C19H32N2S and a molecular weight of 320.55 g/mol. Its IUPAC name is 2-methyl-4-[2-(10-propan-2-yl-3-azaspiro[5.5]undecan-3-yl)ethyl]-1,3-thiazole.

Molecular Properties

Compound Name2-methyl-4-[2-(10-propan-2-yl-3-azaspiro[5.5]undecan-3-yl)ethyl]-1,3-thiazole
PubChem CID155632192
Molecular FormulaC19H32N2S
Molecular Weight320.55 g/mol
Exact Mass320.23
IUPAC Name2-methyl-4-[2-(10-propan-2-yl-3-azaspiro[5.5]undecan-3-yl)ethyl]-1,3-thiazole
SMILESCc1nc(CCN2CCC3(CCCC(C(C)C)C3)CC2)cs1
InChIInChI=1S/C19H32N2S/c1-15(2)17-5-4-7-19(13-17)8-11-21(12-9-19)10-6-18-14-22-16(3)20-18/h14-15,17H,4-13H2,1-3H3
InChIKeyYXUSPVSPRCMDFF-UHFFFAOYSA-N
XLogP4.92
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.55
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-methyl-4-[2-(10-propan-2-yl-3-azaspiro[5.5]undecan-3-yl)ethyl]-1,3-thiazole with MolForge

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Related Compounds

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2-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-9-oxa-2-azaspiro[5.5]undecane
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2-methyl-4-(2-piperazin-1-ylethyl)-1,3-thiazole
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4-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperazine-2,6-dione
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2-methyl-4-[2-[3-(2-methylpropyl)piperazin-1-yl]ethyl]-1,3-thiazole
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4-[2-(3-cyclopropyl-1,4-diazepan-1-yl)ethyl]-2-methyl-1,3-thiazole
CID 106043577
N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-1-(1-propylpiperidin-4-yl)ethanamine
CID 106038848
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Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-[2-(10-propan-2-yl-3-azaspiro[5.5]undecan-3-yl)ethyl]-1,3-thiazole?
The IUPAC name of 2-methyl-4-[2-(10-propan-2-yl-3-azaspiro[5.5]undecan-3-yl)ethyl]-1,3-thiazole (CID 155632192) is 2-methyl-4-[2-(10-propan-2-yl-3-azaspiro[5.5]undecan-3-yl)ethyl]-1,3-thiazole.
What is the SMILES notation for 2-methyl-4-[2-(10-propan-2-yl-3-azaspiro[5.5]undecan-3-yl)ethyl]-1,3-thiazole?
The canonical SMILES for 2-methyl-4-[2-(10-propan-2-yl-3-azaspiro[5.5]undecan-3-yl)ethyl]-1,3-thiazole is Cc1nc(CCN2CCC3(CCCC(C(C)C)C3)CC2)cs1.
What is the InChIKey of 2-methyl-4-[2-(10-propan-2-yl-3-azaspiro[5.5]undecan-3-yl)ethyl]-1,3-thiazole?
The InChIKey is YXUSPVSPRCMDFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2S/c1-15(2)17-5-4-7-19(13-17)8-11-21(12-9-19)10-6-18-14-22-16(3)20-18/h14-15,17H,4-13H2,1-3H3.
What are the key properties of 2-methyl-4-[2-(10-propan-2-yl-3-azaspiro[5.5]undecan-3-yl)ethyl]-1,3-thiazole?
2-methyl-4-[2-(10-propan-2-yl-3-azaspiro[5.5]undecan-3-yl)ethyl]-1,3-thiazole has a molecular weight of 320.55 g/mol, XLogP of 4.92, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-[2-(10-propan-2-yl-3-azaspiro[5.5]undecan-3-yl)ethyl]-1,3-thiazole is sourced from PubChem (CID 155632192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).