2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methyltetrazol-5-yl)-2-azaspiro[4.5]decan-8-yl]acetamide

C17H25N7O2 — CID 166434403

IUPAC2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methyltetrazol-5-yl)-2-azaspiro[4.5]decan-8-yl]acetamide
SMILESCc1cc(CC(=O)NC2CCC3(CC2)CCN(c2nnnn2C)C3)on1
InChIInChI=1S/C17H25N7O2/c1-12-9-14(26-20-12)10-15(25)18-13-3-5-17(6-4-13)7-8-24(11-17)16-19-21-22-23(16)2/h9,13H,3-8,10-11H2,1-2H3,(H,18,25)
InChIKeyROSQXMCZOYWCIU-UHFFFAOYSA-N
MW359.43 g/mol
LogP1.00
Rot. Bonds4

About 2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methyltetrazol-5-yl)-2-azaspiro[4.5]decan-8-yl]acetamide

2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methyltetrazol-5-yl)-2-azaspiro[4.5]decan-8-yl]acetamide (PubChem CID 166434403) has the molecular formula C17H25N7O2 and a molecular weight of 359.43 g/mol. Its IUPAC name is 2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methyltetrazol-5-yl)-2-azaspiro[4.5]decan-8-yl]acetamide.

Molecular Properties

Compound Name2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methyltetrazol-5-yl)-2-azaspiro[4.5]decan-8-yl]acetamide
PubChem CID166434403
Molecular FormulaC17H25N7O2
Molecular Weight359.43 g/mol
Exact Mass359.21
IUPAC Name2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methyltetrazol-5-yl)-2-azaspiro[4.5]decan-8-yl]acetamide
SMILESCc1cc(CC(=O)NC2CCC3(CC2)CCN(c2nnnn2C)C3)on1
InChIInChI=1S/C17H25N7O2/c1-12-9-14(26-20-12)10-15(25)18-13-3-5-17(6-4-13)7-8-24(11-17)16-19-21-22-23(16)2/h9,13H,3-8,10-11H2,1-2H3,(H,18,25)
InChIKeyROSQXMCZOYWCIU-UHFFFAOYSA-N
XLogP1.00
TPSA101.97 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

N-cyclopropyl-2-[4-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]phenyl]acetamide
CID 131897959
N-[(3R)-1-[(3-hydroxyphenyl)methyl]piperidin-3-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 125176454
N-[4-[2-[2-(3,3-dimethylazetidin-1-yl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 138671314
formic acid;4-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-N-[2-(4-methyltriazol-1-yl)ethyl]cyclohexane-1-carboxamide
CID 171339603
N-[3-[5-[(dimethylamino)methyl]-4-methyl-1,2,4-triazol-3-yl]cyclobutyl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 91792882
N-[1-(furan-2-carbonyl)piperidin-3-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 131939712
N-cyclopropyl-3-fluoro-1-[(3-methyl-1,2-oxazol-5-yl)methyl]pyrrolidine-3-carboxamide
CID 171334002
N-[(3R)-1-(benzenesulfonyl)azepan-3-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 96580597
2-(3-methyl-1,2-oxazol-5-yl)acetohydrazide;hydrochloride
CID 66651040
N-[(3R,4R)-4-ethoxy-1-methylpyrrolidin-3-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 133266460
N-[1-[(2R)-1-(N-benzylsulfanylanilino)propan-2-yl]piperidin-4-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 89206644
(2S,4R)-1-cyclopentyl-N,N-diethyl-4-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]pyrrolidine-2-carboxamide
CID 72852321

Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methyltetrazol-5-yl)-2-azaspiro[4.5]decan-8-yl]acetamide?
The IUPAC name of 2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methyltetrazol-5-yl)-2-azaspiro[4.5]decan-8-yl]acetamide (CID 166434403) is 2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methyltetrazol-5-yl)-2-azaspiro[4.5]decan-8-yl]acetamide.
What is the SMILES notation for 2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methyltetrazol-5-yl)-2-azaspiro[4.5]decan-8-yl]acetamide?
The canonical SMILES for 2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methyltetrazol-5-yl)-2-azaspiro[4.5]decan-8-yl]acetamide is Cc1cc(CC(=O)NC2CCC3(CC2)CCN(c2nnnn2C)C3)on1.
What is the InChIKey of 2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methyltetrazol-5-yl)-2-azaspiro[4.5]decan-8-yl]acetamide?
The InChIKey is ROSQXMCZOYWCIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N7O2/c1-12-9-14(26-20-12)10-15(25)18-13-3-5-17(6-4-13)7-8-24(11-17)16-19-21-22-23(16)2/h9,13H,3-8,10-11H2,1-2H3,(H,18,25).
What are the key properties of 2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methyltetrazol-5-yl)-2-azaspiro[4.5]decan-8-yl]acetamide?
2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methyltetrazol-5-yl)-2-azaspiro[4.5]decan-8-yl]acetamide has a molecular weight of 359.43 g/mol, XLogP of 1.00, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methyltetrazol-5-yl)-2-azaspiro[4.5]decan-8-yl]acetamide is sourced from PubChem (CID 166434403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).