(2-cyclopentylpyrrolidin-1-yl)-[1-(2-methylpropyl)piperidin-4-yl]methanone

C19H34N2O — CID 136578094

IUPAC(2-cyclopentylpyrrolidin-1-yl)-[1-(2-methylpropyl)piperidin-4-yl]methanone
SMILESCC(C)CN1CCC(C(=O)N2CCCC2C2CCCC2)CC1
InChIInChI=1S/C19H34N2O/c1-15(2)14-20-12-9-17(10-13-20)19(22)21-11-5-8-18(21)16-6-3-4-7-16/h15-18H,3-14H2,1-2H3
InChIKeyOKBSNIOTZJIYLJ-UHFFFAOYSA-N
MW306.49 g/mol
LogP3.54
Rot. Bonds4

About (2-cyclopentylpyrrolidin-1-yl)-[1-(2-methylpropyl)piperidin-4-yl]methanone

(2-cyclopentylpyrrolidin-1-yl)-[1-(2-methylpropyl)piperidin-4-yl]methanone (PubChem CID 136578094) has the molecular formula C19H34N2O and a molecular weight of 306.49 g/mol. Its IUPAC name is (2-cyclopentylpyrrolidin-1-yl)-[1-(2-methylpropyl)piperidin-4-yl]methanone.

Molecular Properties

Compound Name(2-cyclopentylpyrrolidin-1-yl)-[1-(2-methylpropyl)piperidin-4-yl]methanone
PubChem CID136578094
Molecular FormulaC19H34N2O
Molecular Weight306.49 g/mol
Exact Mass306.27
IUPAC Name(2-cyclopentylpyrrolidin-1-yl)-[1-(2-methylpropyl)piperidin-4-yl]methanone
SMILESCC(C)CN1CCC(C(=O)N2CCCC2C2CCCC2)CC1
InChIInChI=1S/C19H34N2O/c1-15(2)14-20-12-9-17(10-13-20)19(22)21-11-5-8-18(21)16-6-3-4-7-16/h15-18H,3-14H2,1-2H3
InChIKeyOKBSNIOTZJIYLJ-UHFFFAOYSA-N
XLogP3.54
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.49
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[(2R)-2-[(2S)-1-ethylpyrrolidin-2-yl]pyrrolidin-1-yl]-[1-(2-methylpropyl)piperidin-4-yl]methanone
CID 129428882
cyclobutyl-(2-cyclopentylpyrrolidin-1-yl)methanone
CID 110871989
cyclopropyl-(2-cyclopropylpyrrolidin-1-yl)methanone
CID 110871757
[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-(2-cyclopropylpyrrolidin-1-yl)methanone
CID 110871814
[2-(aminomethyl)piperidin-1-yl]-[1-(2-methylpropyl)pyrrolidin-3-yl]methanone
CID 126790046
[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
[(1S,3R)-3-aminocyclopentyl]-[(2R)-2-cyclopentylpyrrolidin-1-yl]methanone
CID 124678579
[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-(3-aminocyclopentyl)methanone
CID 102726153
3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl-(3-amino-4-methylcyclohexyl)methanone
CID 62781711
cyclohexyl-[4-(2-methylpropyl)piperazin-1-yl]methanone
CID 113072857
1-[(8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]ethanone
CID 68573047

Frequently Asked Questions

What is the IUPAC name of (2-cyclopentylpyrrolidin-1-yl)-[1-(2-methylpropyl)piperidin-4-yl]methanone?
The IUPAC name of (2-cyclopentylpyrrolidin-1-yl)-[1-(2-methylpropyl)piperidin-4-yl]methanone (CID 136578094) is (2-cyclopentylpyrrolidin-1-yl)-[1-(2-methylpropyl)piperidin-4-yl]methanone.
What is the SMILES notation for (2-cyclopentylpyrrolidin-1-yl)-[1-(2-methylpropyl)piperidin-4-yl]methanone?
The canonical SMILES for (2-cyclopentylpyrrolidin-1-yl)-[1-(2-methylpropyl)piperidin-4-yl]methanone is CC(C)CN1CCC(C(=O)N2CCCC2C2CCCC2)CC1.
What is the InChIKey of (2-cyclopentylpyrrolidin-1-yl)-[1-(2-methylpropyl)piperidin-4-yl]methanone?
The InChIKey is OKBSNIOTZJIYLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N2O/c1-15(2)14-20-12-9-17(10-13-20)19(22)21-11-5-8-18(21)16-6-3-4-7-16/h15-18H,3-14H2,1-2H3.
What are the key properties of (2-cyclopentylpyrrolidin-1-yl)-[1-(2-methylpropyl)piperidin-4-yl]methanone?
(2-cyclopentylpyrrolidin-1-yl)-[1-(2-methylpropyl)piperidin-4-yl]methanone has a molecular weight of 306.49 g/mol, XLogP of 3.54, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopentylpyrrolidin-1-yl)-[1-(2-methylpropyl)piperidin-4-yl]methanone is sourced from PubChem (CID 136578094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).