N-[5-[[2-(6-ethylpyrazin-2-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide

C19H26N6OS — CID 142408866

IUPACN-[5-[[2-(6-ethylpyrazin-2-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide
SMILESCCc1cncc(N2CCC3(CCN(Cc4cnc(NC(C)=O)s4)C3)C2)n1
InChIInChI=1S/C19H26N6OS/c1-3-15-8-20-10-17(23-15)25-7-5-19(13-25)4-6-24(12-19)11-16-9-21-18(27-16)22-14(2)26/h8-10H,3-7,11-13H2,1-2H3,(H,21,22,26)
InChIKeyFASDVYMDUXGMRO-UHFFFAOYSA-N
MW386.53 g/mol
LogP2.56
Rot. Bonds5

About N-[5-[[2-(6-ethylpyrazin-2-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide

N-[5-[[2-(6-ethylpyrazin-2-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide (PubChem CID 142408866) has the molecular formula C19H26N6OS and a molecular weight of 386.53 g/mol. Its IUPAC name is N-[5-[[2-(6-ethylpyrazin-2-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[5-[[2-(6-ethylpyrazin-2-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide
PubChem CID142408866
Molecular FormulaC19H26N6OS
Molecular Weight386.53 g/mol
Exact Mass386.19
IUPAC NameN-[5-[[2-(6-ethylpyrazin-2-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide
SMILESCCc1cncc(N2CCC3(CCN(Cc4cnc(NC(C)=O)s4)C3)C2)n1
InChIInChI=1S/C19H26N6OS/c1-3-15-8-20-10-17(23-15)25-7-5-19(13-25)4-6-24(12-19)11-16-9-21-18(27-16)22-14(2)26/h8-10H,3-7,11-13H2,1-2H3,(H,21,22,26)
InChIKeyFASDVYMDUXGMRO-UHFFFAOYSA-N
XLogP2.56
TPSA74.25 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.53
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[5-[[2-(5-methylimidazo[1,2-a]pyrimidin-7-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 162654867
N-[5-[[2-(6-cyclopropylpyrazin-2-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 135301762
N-[5-[[2-(2,6-dimethylpyrimidin-4-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 135301919
N-[5-[[4-[2-(6-methylpyrazin-2-yl)ethynyl]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 177377629
N-[5-[[(5S)-2-(5-methylimidazo[1,2-a]pyrimidin-7-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 155804590
N-[5-[[3-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]pyrrolidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 142375492
N-[5-[[3-[(5,6-dimethylpyrazin-2-yl)methyl]pyrrolidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 135135154
N-[5-[[3-[(5-cyanopyrazin-2-yl)methyl]pyrrolidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 135135161
N-[5-[[3-[(5,6-dimethylpyrazin-2-yl)methyl]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 135135167
N-[5-[[3-[(3,6-dimethylpyrazin-2-yl)methyl]pyrrolidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 135135432
N-[5-[[3-[(6-methylpyrazin-2-yl)methyl]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 135135506
5-[[1-[(2-Acetamido-1,3-thiazol-5-yl)methyl]pyrrolidin-3-yl]methyl]pyrazine-2-carboxamide
CID 135135522

Frequently Asked Questions

What is the IUPAC name of N-[5-[[2-(6-ethylpyrazin-2-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide?
The IUPAC name of N-[5-[[2-(6-ethylpyrazin-2-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide (CID 142408866) is N-[5-[[2-(6-ethylpyrazin-2-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for N-[5-[[2-(6-ethylpyrazin-2-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for N-[5-[[2-(6-ethylpyrazin-2-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide is CCc1cncc(N2CCC3(CCN(Cc4cnc(NC(C)=O)s4)C3)C2)n1.
What is the InChIKey of N-[5-[[2-(6-ethylpyrazin-2-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide?
The InChIKey is FASDVYMDUXGMRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N6OS/c1-3-15-8-20-10-17(23-15)25-7-5-19(13-25)4-6-24(12-19)11-16-9-21-18(27-16)22-14(2)26/h8-10H,3-7,11-13H2,1-2H3,(H,21,22,26).
What are the key properties of N-[5-[[2-(6-ethylpyrazin-2-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide?
N-[5-[[2-(6-ethylpyrazin-2-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide has a molecular weight of 386.53 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[[2-(6-ethylpyrazin-2-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 142408866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).