N-(2-methylbutan-2-yl)-4,8-diazaspiro[2.6]nonane-8-carboxamide

C13H25N3O — CID 165478698

IUPACN-(2-methylbutan-2-yl)-4,8-diazaspiro[2.6]nonane-8-carboxamide
SMILESCCC(C)(C)NC(=O)N1CCCNC2(CC2)C1
InChIInChI=1S/C13H25N3O/c1-4-12(2,3)15-11(17)16-9-5-8-14-13(10-16)6-7-13/h14H,4-10H2,1-3H3,(H,15,17)
InChIKeyRYULOTNRXPUCSG-UHFFFAOYSA-N
MW239.36 g/mol
LogP1.71
Rot. Bonds2

About N-(2-methylbutan-2-yl)-4,8-diazaspiro[2.6]nonane-8-carboxamide

N-(2-methylbutan-2-yl)-4,8-diazaspiro[2.6]nonane-8-carboxamide (PubChem CID 165478698) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is N-(2-methylbutan-2-yl)-4,8-diazaspiro[2.6]nonane-8-carboxamide.

Molecular Properties

Compound NameN-(2-methylbutan-2-yl)-4,8-diazaspiro[2.6]nonane-8-carboxamide
PubChem CID165478698
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC NameN-(2-methylbutan-2-yl)-4,8-diazaspiro[2.6]nonane-8-carboxamide
SMILESCCC(C)(C)NC(=O)N1CCCNC2(CC2)C1
InChIInChI=1S/C13H25N3O/c1-4-12(2,3)15-11(17)16-9-5-8-14-13(10-16)6-7-13/h14H,4-10H2,1-3H3,(H,15,17)
InChIKeyRYULOTNRXPUCSG-UHFFFAOYSA-N
XLogP1.71
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-methylbutan-2-yl)azepane-1-carboxamide
CID 116653730
4-ethyl-1-(2-methylbutan-2-ylcarbamoyl)piperidine-4-carboxylic acid
CID 55177965
tert-butyl 1,9-diazaspiro[4.5]decane-9-carboxylate
CID 42614152
methyl 4-(2-methylbutan-2-ylcarbamoyl)piperazine-1-carboxylate
CID 70950413
2,2,3-trimethyl-N-(2-methylbutan-2-yl)aziridine-1-carboxamide
CID 6421387
1-(3-ethylpentan-3-ylcarbamoyl)-3-methylpiperidine-3-carboxylic acid
CID 65042596
2-[3-methyl-1-(2-methylbutan-2-ylcarbamoyl)azetidin-3-yl]oxyacetic acid
CID 102658447
2-methyl-1-(2-methylbutan-2-ylcarbamoyl)piperidine-2-carboxylic acid
CID 104597770
4,7-diazaspiro[2.5]octane-7-carboxylic acid
CID 89157543
tert-butyl 2,6-diazaspiro[4.6]undecane-2-carboxylate
CID 82623314
3-methyl-3-(pyrrolidine-1-carbonylamino)butanoic acid
CID 64700424
N-tert-butyl-3-hydroxy-3-methylpiperidine-1-carboxamide
CID 115872033

Frequently Asked Questions

What is the IUPAC name of N-(2-methylbutan-2-yl)-4,8-diazaspiro[2.6]nonane-8-carboxamide?
The IUPAC name of N-(2-methylbutan-2-yl)-4,8-diazaspiro[2.6]nonane-8-carboxamide (CID 165478698) is N-(2-methylbutan-2-yl)-4,8-diazaspiro[2.6]nonane-8-carboxamide.
What is the SMILES notation for N-(2-methylbutan-2-yl)-4,8-diazaspiro[2.6]nonane-8-carboxamide?
The canonical SMILES for N-(2-methylbutan-2-yl)-4,8-diazaspiro[2.6]nonane-8-carboxamide is CCC(C)(C)NC(=O)N1CCCNC2(CC2)C1.
What is the InChIKey of N-(2-methylbutan-2-yl)-4,8-diazaspiro[2.6]nonane-8-carboxamide?
The InChIKey is RYULOTNRXPUCSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-4-12(2,3)15-11(17)16-9-5-8-14-13(10-16)6-7-13/h14H,4-10H2,1-3H3,(H,15,17).
What are the key properties of N-(2-methylbutan-2-yl)-4,8-diazaspiro[2.6]nonane-8-carboxamide?
N-(2-methylbutan-2-yl)-4,8-diazaspiro[2.6]nonane-8-carboxamide has a molecular weight of 239.36 g/mol, XLogP of 1.71, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylbutan-2-yl)-4,8-diazaspiro[2.6]nonane-8-carboxamide is sourced from PubChem (CID 165478698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).