6-azaspiro[2.5]octan-2-yl-(2,3-dichlorophenyl)methanone

C14H15Cl2NO — CID 116573087

IUPAC6-azaspiro[2.5]octan-2-yl-(2,3-dichlorophenyl)methanone
SMILESO=C(c1cccc(Cl)c1Cl)C1CC12CCNCC2
InChIInChI=1S/C14H15Cl2NO/c15-11-3-1-2-9(12(11)16)13(18)10-8-14(10)4-6-17-7-5-14/h1-3,10,17H,4-8H2
InChIKeyGHPXHTFEYYKANY-UHFFFAOYSA-N
MW284.19 g/mol
LogP3.57
Rot. Bonds2

About 6-azaspiro[2.5]octan-2-yl-(2,3-dichlorophenyl)methanone

6-azaspiro[2.5]octan-2-yl-(2,3-dichlorophenyl)methanone (PubChem CID 116573087) has the molecular formula C14H15Cl2NO and a molecular weight of 284.19 g/mol. Its IUPAC name is 6-azaspiro[2.5]octan-2-yl-(2,3-dichlorophenyl)methanone.

Molecular Properties

Compound Name6-azaspiro[2.5]octan-2-yl-(2,3-dichlorophenyl)methanone
PubChem CID116573087
Molecular FormulaC14H15Cl2NO
Molecular Weight284.19 g/mol
Exact Mass283.05
IUPAC Name6-azaspiro[2.5]octan-2-yl-(2,3-dichlorophenyl)methanone
SMILESO=C(c1cccc(Cl)c1Cl)C1CC12CCNCC2
InChIInChI=1S/C14H15Cl2NO/c15-11-3-1-2-9(12(11)16)13(18)10-8-14(10)4-6-17-7-5-14/h1-3,10,17H,4-8H2
InChIKeyGHPXHTFEYYKANY-UHFFFAOYSA-N
XLogP3.57
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.19
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,6-dichlorophenyl)-6-azaspiro[2.5]octane-2-carboxamide
CID 65469174
6-azaspiro[2.5]octan-2-yl(naphthalen-2-yl)methanone
CID 116573122
6-azaspiro[2.5]octan-2-yl(furan-3-yl)methanone
CID 116573257
2,3-dichloro-N-(3-methylpyrrolidin-3-yl)benzamide
CID 107422948
6-azaspiro[2.5]octan-2-yl-(4-methoxy-2,5-dimethylphenyl)methanone
CID 116573146
6-azaspiro[2.5]octane-2-carboxylic acid
CID 51342230
N-[2-(2-chloro-6-methylphenoxy)ethyl]-6-azaspiro[2.5]octane-2-carboxamide;hydrochloride
CID 154900624
1-(6-azaspiro[2.5]octan-2-yl)-2-(2-chloro-5-fluorophenyl)ethanone
CID 102622121
6-azaspiro[2.5]octan-2-yl(2,3-dihydro-1,4-benzodioxin-6-yl)methanone
CID 116573161
(2-chloro-3-fluorophenyl)-piperidin-4-ylmethanone;hydrochloride
CID 90038201
7-bicyclo[4.2.0]octa-1,3,5-trienyl-(2,3-dichlorophenyl)methanone
CID 64982050
2-adamantyl-(2,3-dichlorophenyl)methanone
CID 114970494

Frequently Asked Questions

What is the IUPAC name of 6-azaspiro[2.5]octan-2-yl-(2,3-dichlorophenyl)methanone?
The IUPAC name of 6-azaspiro[2.5]octan-2-yl-(2,3-dichlorophenyl)methanone (CID 116573087) is 6-azaspiro[2.5]octan-2-yl-(2,3-dichlorophenyl)methanone.
What is the SMILES notation for 6-azaspiro[2.5]octan-2-yl-(2,3-dichlorophenyl)methanone?
The canonical SMILES for 6-azaspiro[2.5]octan-2-yl-(2,3-dichlorophenyl)methanone is O=C(c1cccc(Cl)c1Cl)C1CC12CCNCC2.
What is the InChIKey of 6-azaspiro[2.5]octan-2-yl-(2,3-dichlorophenyl)methanone?
The InChIKey is GHPXHTFEYYKANY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15Cl2NO/c15-11-3-1-2-9(12(11)16)13(18)10-8-14(10)4-6-17-7-5-14/h1-3,10,17H,4-8H2.
What are the key properties of 6-azaspiro[2.5]octan-2-yl-(2,3-dichlorophenyl)methanone?
6-azaspiro[2.5]octan-2-yl-(2,3-dichlorophenyl)methanone has a molecular weight of 284.19 g/mol, XLogP of 3.57, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-azaspiro[2.5]octan-2-yl-(2,3-dichlorophenyl)methanone is sourced from PubChem (CID 116573087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).