1-(2-cyclobutylpyrrolidin-1-yl)-2-(cyclopropylmethylamino)ethanone

C14H24N2O — CID 119765732

IUPAC1-(2-cyclobutylpyrrolidin-1-yl)-2-(cyclopropylmethylamino)ethanone
SMILESO=C(CNCC1CC1)N1CCCC1C1CCC1
InChIInChI=1S/C14H24N2O/c17-14(10-15-9-11-6-7-11)16-8-2-5-13(16)12-3-1-4-12/h11-13,15H,1-10H2
InChIKeyGJBRPRBLACTXGY-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.78
Rot. Bonds5

About 1-(2-cyclobutylpyrrolidin-1-yl)-2-(cyclopropylmethylamino)ethanone

1-(2-cyclobutylpyrrolidin-1-yl)-2-(cyclopropylmethylamino)ethanone (PubChem CID 119765732) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 1-(2-cyclobutylpyrrolidin-1-yl)-2-(cyclopropylmethylamino)ethanone.

Molecular Properties

Compound Name1-(2-cyclobutylpyrrolidin-1-yl)-2-(cyclopropylmethylamino)ethanone
PubChem CID119765732
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name1-(2-cyclobutylpyrrolidin-1-yl)-2-(cyclopropylmethylamino)ethanone
SMILESO=C(CNCC1CC1)N1CCCC1C1CCC1
InChIInChI=1S/C14H24N2O/c17-14(10-15-9-11-6-7-11)16-8-2-5-13(16)12-3-1-4-12/h11-13,15H,1-10H2
InChIKeyGJBRPRBLACTXGY-UHFFFAOYSA-N
XLogP1.78
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(4aS,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-[[1-(2-hydroxyethyl)piperidin-4-yl]methylamino]ethanone
CID 97080390
1,4-bis(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)butane-1,4-dione
CID 66795041
1-[2-(cyclopropylmethylamino)acetyl]pyrrolidine-2-carboxylic acid
CID 61157492
1-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-2-(ethylamino)ethanone
CID 81489176
1-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-5-chloropentan-1-one
CID 65319414
1-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-4-(methylamino)butan-1-one;hydrochloride
CID 119751074
2-amino-1-(2-cyclohexylpyrrolidin-1-yl)ethanone
CID 60946954
1-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-4-chlorobutan-1-one
CID 63309531
5-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-5-oxopentanoic acid
CID 43406528
1-(4-acetyl-1,4-diazepan-1-yl)-2-(cyclopropylmethylamino)ethanone;hydrochloride
CID 119399355
3-amino-1-(2-cyclohexylpyrrolidin-1-yl)propan-1-one;hydrochloride
CID 119288477
2-(cyclopropylmethylamino)-1-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)ethanone
CID 81200466

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclobutylpyrrolidin-1-yl)-2-(cyclopropylmethylamino)ethanone?
The IUPAC name of 1-(2-cyclobutylpyrrolidin-1-yl)-2-(cyclopropylmethylamino)ethanone (CID 119765732) is 1-(2-cyclobutylpyrrolidin-1-yl)-2-(cyclopropylmethylamino)ethanone.
What is the SMILES notation for 1-(2-cyclobutylpyrrolidin-1-yl)-2-(cyclopropylmethylamino)ethanone?
The canonical SMILES for 1-(2-cyclobutylpyrrolidin-1-yl)-2-(cyclopropylmethylamino)ethanone is O=C(CNCC1CC1)N1CCCC1C1CCC1.
What is the InChIKey of 1-(2-cyclobutylpyrrolidin-1-yl)-2-(cyclopropylmethylamino)ethanone?
The InChIKey is GJBRPRBLACTXGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c17-14(10-15-9-11-6-7-11)16-8-2-5-13(16)12-3-1-4-12/h11-13,15H,1-10H2.
What are the key properties of 1-(2-cyclobutylpyrrolidin-1-yl)-2-(cyclopropylmethylamino)ethanone?
1-(2-cyclobutylpyrrolidin-1-yl)-2-(cyclopropylmethylamino)ethanone has a molecular weight of 236.36 g/mol, XLogP of 1.78, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclobutylpyrrolidin-1-yl)-2-(cyclopropylmethylamino)ethanone is sourced from PubChem (CID 119765732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).