2-cyclopentyl-1-(diazinan-1-yl)ethanone

C11H20N2O — CID 130871502

IUPAC2-cyclopentyl-1-(diazinan-1-yl)ethanone
SMILESO=C(CC1CCCC1)N1CCCCN1
InChIInChI=1S/C11H20N2O/c14-11(9-10-5-1-2-6-10)13-8-4-3-7-12-13/h10,12H,1-9H2
InChIKeyKJXLSLRFAPMIJB-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.69
Rot. Bonds2

About 2-cyclopentyl-1-(diazinan-1-yl)ethanone

2-cyclopentyl-1-(diazinan-1-yl)ethanone (PubChem CID 130871502) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 2-cyclopentyl-1-(diazinan-1-yl)ethanone.

Molecular Properties

Compound Name2-cyclopentyl-1-(diazinan-1-yl)ethanone
PubChem CID130871502
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name2-cyclopentyl-1-(diazinan-1-yl)ethanone
SMILESO=C(CC1CCCC1)N1CCCCN1
InChIInChI=1S/C11H20N2O/c14-11(9-10-5-1-2-6-10)13-8-4-3-7-12-13/h10,12H,1-9H2
InChIKeyKJXLSLRFAPMIJB-UHFFFAOYSA-N
XLogP1.69
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopentyl-1-(1,4-diazepan-1-yl)ethanone;hydrochloride
CID 50988752
(8aR,12aS)-1-(2-cyclohexylacetyl)-2,3,4,5,6,7,8a,9,10,11,12,12a-dodecahydrobenzo[b][1,5]diazecin-8-one
CID 110201298
2-cyclohexyl-1-(2,2-dimethylpiperazin-1-yl)ethanone
CID 65463150
2-cyclopentyl-1-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]ethanone
CID 61175911
1-(2-cyclohexylacetyl)piperidine-4-carboxylic acid
CID 43183394
diazinan-1-yl-(2,2-dichlorocyclopropyl)methanone
CID 130677729
1-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentylethanone
CID 39997538
2-cyclohexyl-1-[4-(pyrrolidine-3-carbonyl)piperazin-1-yl]ethanone
CID 119767012
2-cycloheptyl-1-(3-piperazin-1-ylpyrrolidin-1-yl)ethanone
CID 120997204
2-cyclopentyl-1-(3,3-dimethylpiperazin-1-yl)ethanone
CID 79506874
1-[4-(azepane-1-carbonyl)piperidin-1-yl]-2-cyclohexylethanone
CID 134029886
2-cycloheptyl-1-(2,3-dimethylpiperazin-1-yl)ethanone
CID 120572103

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-(diazinan-1-yl)ethanone?
The IUPAC name of 2-cyclopentyl-1-(diazinan-1-yl)ethanone (CID 130871502) is 2-cyclopentyl-1-(diazinan-1-yl)ethanone.
What is the SMILES notation for 2-cyclopentyl-1-(diazinan-1-yl)ethanone?
The canonical SMILES for 2-cyclopentyl-1-(diazinan-1-yl)ethanone is O=C(CC1CCCC1)N1CCCCN1.
What is the InChIKey of 2-cyclopentyl-1-(diazinan-1-yl)ethanone?
The InChIKey is KJXLSLRFAPMIJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c14-11(9-10-5-1-2-6-10)13-8-4-3-7-12-13/h10,12H,1-9H2.
What are the key properties of 2-cyclopentyl-1-(diazinan-1-yl)ethanone?
2-cyclopentyl-1-(diazinan-1-yl)ethanone has a molecular weight of 196.29 g/mol, XLogP of 1.69, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-(diazinan-1-yl)ethanone is sourced from PubChem (CID 130871502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).