cyclobutyl-(2-cyclopropylpyrrolidin-1-yl)methanone

C12H19NO — CID 110871814

IUPACcyclobutyl-(2-cyclopropylpyrrolidin-1-yl)methanone
SMILESO=C(C1CCC1)N1CCCC1C1CC1
InChIInChI=1S/C12H19NO/c14-12(10-3-1-4-10)13-8-2-5-11(13)9-6-7-9/h9-11H,1-8H2
InChIKeyBOANYUHAYVLDEV-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.19
Rot. Bonds2

About cyclobutyl-(2-cyclopropylpyrrolidin-1-yl)methanone

cyclobutyl-(2-cyclopropylpyrrolidin-1-yl)methanone (PubChem CID 110871814) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is cyclobutyl-(2-cyclopropylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Namecyclobutyl-(2-cyclopropylpyrrolidin-1-yl)methanone
PubChem CID110871814
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Namecyclobutyl-(2-cyclopropylpyrrolidin-1-yl)methanone
SMILESO=C(C1CCC1)N1CCCC1C1CC1
InChIInChI=1S/C12H19NO/c14-12(10-3-1-4-10)13-8-2-5-11(13)9-6-7-9/h9-11H,1-8H2
InChIKeyBOANYUHAYVLDEV-UHFFFAOYSA-N
XLogP2.19
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

cyclobutyl-(2-cyclopentylpyrrolidin-1-yl)methanone
CID 110871989
cyclopropyl-(2-cyclopropylpyrrolidin-1-yl)methanone
CID 110871757
[3-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carbonyl)cyclohexyl]-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)methanone
CID 60596758
(3-aminocyclohexyl)-(2-cyclobutylpyrrolidin-1-yl)methanone
CID 119765726
(3-aminocyclohexyl)-(2-cyclopentylpyrrolidin-1-yl)methanone
CID 62777355
[4-(2,3,3a,4,5,6,7,7a-octahydroindole-1-carbonyl)cyclohexyl]-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)methanone
CID 171722445
cyclobutyl-[(2R)-2-[(2R)-1-methylpyrrolidin-2-yl]pyrrolidin-1-yl]methanone
CID 129428271
3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl-(3-aminocyclohexyl)methanone;hydrochloride
CID 119686901
(2-cyclobutylpyrrolidin-1-yl)-piperidin-3-ylmethanone;hydrochloride
CID 119313249
[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-piperidin-3-ylmethanone
CID 102726290
cyclopentyl-[(2S)-2-[(2S)-1-methylpyrrolidin-2-yl]pyrrolidin-1-yl]methanone
CID 95311578
[(1S,3R)-3-aminocyclopentyl]-[(2R)-2-cyclopentylpyrrolidin-1-yl]methanone
CID 124678579

Frequently Asked Questions

What is the IUPAC name of cyclobutyl-(2-cyclopropylpyrrolidin-1-yl)methanone?
The IUPAC name of cyclobutyl-(2-cyclopropylpyrrolidin-1-yl)methanone (CID 110871814) is cyclobutyl-(2-cyclopropylpyrrolidin-1-yl)methanone.
What is the SMILES notation for cyclobutyl-(2-cyclopropylpyrrolidin-1-yl)methanone?
The canonical SMILES for cyclobutyl-(2-cyclopropylpyrrolidin-1-yl)methanone is O=C(C1CCC1)N1CCCC1C1CC1.
What is the InChIKey of cyclobutyl-(2-cyclopropylpyrrolidin-1-yl)methanone?
The InChIKey is BOANYUHAYVLDEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c14-12(10-3-1-4-10)13-8-2-5-11(13)9-6-7-9/h9-11H,1-8H2.
What are the key properties of cyclobutyl-(2-cyclopropylpyrrolidin-1-yl)methanone?
cyclobutyl-(2-cyclopropylpyrrolidin-1-yl)methanone has a molecular weight of 193.29 g/mol, XLogP of 2.19, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl-(2-cyclopropylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 110871814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).