2-(2,7-diazaspiro[4.4]nonan-2-yl)-N-(2-methylpropyl)acetamide

C13H25N3O — CID 113447206

IUPAC2-(2,7-diazaspiro[4.4]nonan-2-yl)-N-(2-methylpropyl)acetamide
SMILESCC(C)CNC(=O)CN1CCC2(CCNC2)C1
InChIInChI=1S/C13H25N3O/c1-11(2)7-15-12(17)8-16-6-4-13(10-16)3-5-14-9-13/h11,14H,3-10H2,1-2H3,(H,15,17)
InChIKeyBOXGZZYXLPXCEL-UHFFFAOYSA-N
MW239.36 g/mol
LogP0.44
Rot. Bonds4

About 2-(2,7-diazaspiro[4.4]nonan-2-yl)-N-(2-methylpropyl)acetamide

2-(2,7-diazaspiro[4.4]nonan-2-yl)-N-(2-methylpropyl)acetamide (PubChem CID 113447206) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 2-(2,7-diazaspiro[4.4]nonan-2-yl)-N-(2-methylpropyl)acetamide.

Molecular Properties

Compound Name2-(2,7-diazaspiro[4.4]nonan-2-yl)-N-(2-methylpropyl)acetamide
PubChem CID113447206
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name2-(2,7-diazaspiro[4.4]nonan-2-yl)-N-(2-methylpropyl)acetamide
SMILESCC(C)CNC(=O)CN1CCC2(CCNC2)C1
InChIInChI=1S/C13H25N3O/c1-11(2)7-15-12(17)8-16-6-4-13(10-16)3-5-14-9-13/h11,14H,3-10H2,1-2H3,(H,15,17)
InChIKeyBOXGZZYXLPXCEL-UHFFFAOYSA-N
XLogP0.44
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-2-(2,8-diazaspiro[5.5]undecan-2-yl)acetamide
CID 102850222
2-ethyl-2,7-diazaspiro[4.4]nonane chloride
CID 53314750
2-(4-cyano-4-methylpiperidin-1-yl)-N-(2-methylpropyl)acetamide
CID 113363017
N-ethyl-2,7-diazaspiro[4.4]nonane-2-carboxamide
CID 130525692
1-(2,7-diazaspiro[4.4]nonan-2-yl)butan-2-ol
CID 130525842
1-[2-(2-methylpropylamino)-2-oxoethyl]-4-propylpiperidine-4-carboxylic acid
CID 63126933
1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-methylpropan-1-one;hydrochloride
CID 169493333
ethyl 2,7-diazaspiro[4.4]nonane-2-carboxylate
CID 82038278
methyl 3-(2,7-diazaspiro[4.4]nonan-2-yl)-2-methylbutanoate
CID 112740327
2-(2,7-diazaspiro[4.4]nonan-2-yl)ethanamine
CID 128922534
ethyl N-[2-(2,8-diazaspiro[5.5]undecan-2-yl)acetyl]carbamate
CID 102850177
2-(2,2-diethylbutyl)-2,7-diazaspiro[4.4]nonane
CID 120907644

Frequently Asked Questions

What is the IUPAC name of 2-(2,7-diazaspiro[4.4]nonan-2-yl)-N-(2-methylpropyl)acetamide?
The IUPAC name of 2-(2,7-diazaspiro[4.4]nonan-2-yl)-N-(2-methylpropyl)acetamide (CID 113447206) is 2-(2,7-diazaspiro[4.4]nonan-2-yl)-N-(2-methylpropyl)acetamide.
What is the SMILES notation for 2-(2,7-diazaspiro[4.4]nonan-2-yl)-N-(2-methylpropyl)acetamide?
The canonical SMILES for 2-(2,7-diazaspiro[4.4]nonan-2-yl)-N-(2-methylpropyl)acetamide is CC(C)CNC(=O)CN1CCC2(CCNC2)C1.
What is the InChIKey of 2-(2,7-diazaspiro[4.4]nonan-2-yl)-N-(2-methylpropyl)acetamide?
The InChIKey is BOXGZZYXLPXCEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-11(2)7-15-12(17)8-16-6-4-13(10-16)3-5-14-9-13/h11,14H,3-10H2,1-2H3,(H,15,17).
What are the key properties of 2-(2,7-diazaspiro[4.4]nonan-2-yl)-N-(2-methylpropyl)acetamide?
2-(2,7-diazaspiro[4.4]nonan-2-yl)-N-(2-methylpropyl)acetamide has a molecular weight of 239.36 g/mol, XLogP of 0.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,7-diazaspiro[4.4]nonan-2-yl)-N-(2-methylpropyl)acetamide is sourced from PubChem (CID 113447206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).