[3-(2-azabicyclo[3.2.0]heptan-1-yl)piperidin-1-yl]-cyclopropylmethanone

C15H24N2O — CID 165488643

IUPAC[3-(2-azabicyclo[3.2.0]heptan-1-yl)piperidin-1-yl]-cyclopropylmethanone
SMILESO=C(C1CC1)N1CCCC(C23CCC2CCN3)C1
InChIInChI=1S/C15H24N2O/c18-14(11-3-4-11)17-9-1-2-13(10-17)15-7-5-12(15)6-8-16-15/h11-13,16H,1-10H2
InChIKeyGFWCFIMGTPPFIR-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.78
Rot. Bonds2

About [3-(2-azabicyclo[3.2.0]heptan-1-yl)piperidin-1-yl]-cyclopropylmethanone

[3-(2-azabicyclo[3.2.0]heptan-1-yl)piperidin-1-yl]-cyclopropylmethanone (PubChem CID 165488643) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is [3-(2-azabicyclo[3.2.0]heptan-1-yl)piperidin-1-yl]-cyclopropylmethanone.

Molecular Properties

Compound Name[3-(2-azabicyclo[3.2.0]heptan-1-yl)piperidin-1-yl]-cyclopropylmethanone
PubChem CID165488643
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name[3-(2-azabicyclo[3.2.0]heptan-1-yl)piperidin-1-yl]-cyclopropylmethanone
SMILESO=C(C1CC1)N1CCCC(C23CCC2CCN3)C1
InChIInChI=1S/C15H24N2O/c18-14(11-3-4-11)17-9-1-2-13(10-17)15-7-5-12(15)6-8-16-15/h11-13,16H,1-10H2
InChIKeyGFWCFIMGTPPFIR-UHFFFAOYSA-N
XLogP1.78
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(3R)-3-(3-azaspiro[5.5]undecane-3-carbonyl)piperidin-1-yl]-cyclopropylmethanone
CID 97080385
cyclopentyl-[(3R)-3-(pyrrolidine-1-carbonyl)piperidin-1-yl]methanone
CID 95051296
cyclopropyl-[3-(4-hydroxy-4-methylpiperidine-1-carbonyl)piperidin-1-yl]methanone
CID 80702617
(4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl)-cyclobutylmethanone
CID 81096994
1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl(cyclopropyl)methanone
CID 49224332
cyclopropyl-[(3S)-3-(methylamino)piperidin-1-yl]methanone
CID 94475773
1-(cyclopropanecarbonyl)piperidine-3-carbaldehyde
CID 55268668
cyclopropyl-[3-(3-hydroxypiperidine-1-carbonyl)piperidin-1-yl]methanone
CID 43502686
cyclopropyl-[3-(2-methoxyethoxy)piperidin-1-yl]methanone
CID 42844209
(4,4-difluorocyclohexyl)-(3-methylpiperidin-1-yl)methanone
CID 91070510
cyclopropyl(1,4-diazepan-1-yl)methanone
CID 16775568
cyclopentyl-[(3S)-3-hydroxypiperidin-1-yl]methanone
CID 93040537

Frequently Asked Questions

What is the IUPAC name of [3-(2-azabicyclo[3.2.0]heptan-1-yl)piperidin-1-yl]-cyclopropylmethanone?
The IUPAC name of [3-(2-azabicyclo[3.2.0]heptan-1-yl)piperidin-1-yl]-cyclopropylmethanone (CID 165488643) is [3-(2-azabicyclo[3.2.0]heptan-1-yl)piperidin-1-yl]-cyclopropylmethanone.
What is the SMILES notation for [3-(2-azabicyclo[3.2.0]heptan-1-yl)piperidin-1-yl]-cyclopropylmethanone?
The canonical SMILES for [3-(2-azabicyclo[3.2.0]heptan-1-yl)piperidin-1-yl]-cyclopropylmethanone is O=C(C1CC1)N1CCCC(C23CCC2CCN3)C1.
What is the InChIKey of [3-(2-azabicyclo[3.2.0]heptan-1-yl)piperidin-1-yl]-cyclopropylmethanone?
The InChIKey is GFWCFIMGTPPFIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c18-14(11-3-4-11)17-9-1-2-13(10-17)15-7-5-12(15)6-8-16-15/h11-13,16H,1-10H2.
What are the key properties of [3-(2-azabicyclo[3.2.0]heptan-1-yl)piperidin-1-yl]-cyclopropylmethanone?
[3-(2-azabicyclo[3.2.0]heptan-1-yl)piperidin-1-yl]-cyclopropylmethanone has a molecular weight of 248.37 g/mol, XLogP of 1.78, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-azabicyclo[3.2.0]heptan-1-yl)piperidin-1-yl]-cyclopropylmethanone is sourced from PubChem (CID 165488643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).