1,2-di(propan-2-yl)-2,7-diazaspiro[3.5]nonan-3-one

C13H24N2O — CID 171080791

IUPAC1,2-di(propan-2-yl)-2,7-diazaspiro[3.5]nonan-3-one
SMILESCC(C)C1N(C(C)C)C(=O)C12CCNCC2
InChIInChI=1S/C13H24N2O/c1-9(2)11-13(5-7-14-8-6-13)12(16)15(11)10(3)4/h9-11,14H,5-8H2,1-4H3
InChIKeyZRRHTPNVWDXBBA-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.63
Rot. Bonds2

About 1,2-di(propan-2-yl)-2,7-diazaspiro[3.5]nonan-3-one

1,2-di(propan-2-yl)-2,7-diazaspiro[3.5]nonan-3-one (PubChem CID 171080791) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 1,2-di(propan-2-yl)-2,7-diazaspiro[3.5]nonan-3-one.

Molecular Properties

Compound Name1,2-di(propan-2-yl)-2,7-diazaspiro[3.5]nonan-3-one
PubChem CID171080791
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name1,2-di(propan-2-yl)-2,7-diazaspiro[3.5]nonan-3-one
SMILESCC(C)C1N(C(C)C)C(=O)C12CCNCC2
InChIInChI=1S/C13H24N2O/c1-9(2)11-13(5-7-14-8-6-13)12(16)15(11)10(3)4/h9-11,14H,5-8H2,1-4H3
InChIKeyZRRHTPNVWDXBBA-UHFFFAOYSA-N
XLogP1.63
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-oxo-1-propan-2-yl-2,7-diazaspiro[3.5]nonan-2-yl)acetamide
CID 171080839
1-methyl-4-propan-2-yl-1,4,9-triazaspiro[5.5]undecan-5-one
CID 121229524
3-methyl-2-propan-2-yl-1,3,8-triazaspiro[4.5]dec-1-en-4-one
CID 86277613
(4R)-4-(3-methoxyphenyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decan-1-one
CID 96530490
3-propan-2-yl-2,8-diazaspiro[4.5]decan-1-one
CID 130888250
N-methyl-3-oxo-2-propan-2-yl-2-azaspiro[3.5]nonane-1-carboxamide
CID 110204020
3-methyl-1-propan-2-yl-1,3,8-triazaspiro[4.5]decan-2-one
CID 83885529
4-propan-2-yl-1-thia-4,8-diazaspiro[4.5]decan-3-one
CID 134389583
3,8-di(propan-2-yl)-1,3-diazaspiro[4.5]decane-2,4-dione
CID 166023004
4-methylidene-3-propan-2-yl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 19814342
7-fluoro-1-propan-2-ylspiro[indole-3,4'-piperidine]-2-one
CID 124527111
2-methyl-2,7-diazaspiro[3.5]nonan-3-one;hydrochloride
CID 135392414

Frequently Asked Questions

What is the IUPAC name of 1,2-di(propan-2-yl)-2,7-diazaspiro[3.5]nonan-3-one?
The IUPAC name of 1,2-di(propan-2-yl)-2,7-diazaspiro[3.5]nonan-3-one (CID 171080791) is 1,2-di(propan-2-yl)-2,7-diazaspiro[3.5]nonan-3-one.
What is the SMILES notation for 1,2-di(propan-2-yl)-2,7-diazaspiro[3.5]nonan-3-one?
The canonical SMILES for 1,2-di(propan-2-yl)-2,7-diazaspiro[3.5]nonan-3-one is CC(C)C1N(C(C)C)C(=O)C12CCNCC2.
What is the InChIKey of 1,2-di(propan-2-yl)-2,7-diazaspiro[3.5]nonan-3-one?
The InChIKey is ZRRHTPNVWDXBBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-9(2)11-13(5-7-14-8-6-13)12(16)15(11)10(3)4/h9-11,14H,5-8H2,1-4H3.
What are the key properties of 1,2-di(propan-2-yl)-2,7-diazaspiro[3.5]nonan-3-one?
1,2-di(propan-2-yl)-2,7-diazaspiro[3.5]nonan-3-one has a molecular weight of 224.35 g/mol, XLogP of 1.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-di(propan-2-yl)-2,7-diazaspiro[3.5]nonan-3-one is sourced from PubChem (CID 171080791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).