2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-cyclopentylpropanamide

C18H31N3O2 — CID 56781705

IUPAC2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-cyclopentylpropanamide
SMILESCC(=O)N1CCCC1C1CCCN1C(C)C(=O)NC1CCCC1
InChIInChI=1S/C18H31N3O2/c1-13(18(23)19-15-7-3-4-8-15)20-11-5-9-16(20)17-10-6-12-21(17)14(2)22/h13,15-17H,3-12H2,1-2H3,(H,19,23)
InChIKeyFNPDDYMSXLVMRS-UHFFFAOYSA-N
MW321.47 g/mol
LogP1.91
Rot. Bonds4

About 2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-cyclopentylpropanamide

2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-cyclopentylpropanamide (PubChem CID 56781705) has the molecular formula C18H31N3O2 and a molecular weight of 321.47 g/mol. Its IUPAC name is 2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-cyclopentylpropanamide.

Molecular Properties

Compound Name2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-cyclopentylpropanamide
PubChem CID56781705
Molecular FormulaC18H31N3O2
Molecular Weight321.47 g/mol
Exact Mass321.24
IUPAC Name2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-cyclopentylpropanamide
SMILESCC(=O)N1CCCC1C1CCCN1C(C)C(=O)NC1CCCC1
InChIInChI=1S/C18H31N3O2/c1-13(18(23)19-15-7-3-4-8-15)20-11-5-9-16(20)17-10-6-12-21(17)14(2)22/h13,15-17H,3-12H2,1-2H3,(H,19,23)
InChIKeyFNPDDYMSXLVMRS-UHFFFAOYSA-N
XLogP1.91
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.47
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-[(2R)-2-[(2R)-1-acetylpyrrolidin-2-yl]pyrrolidin-1-yl]-1-(azepan-1-yl)propan-1-one
CID 129426502
(2S)-2-[(2S)-2-[(2R)-1-acetylpyrrolidin-2-yl]pyrrolidin-1-yl]-1-morpholin-4-ylpropan-1-one
CID 100844075
2-(4-acetylpiperazin-1-yl)-N-cyclopentylpropanamide
CID 123939055
N-cyclopentyl-2-(2-formylpiperidin-1-yl)propanamide
CID 62655889
1-[(8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]ethanone
CID 68573047
N-cyclohexyl-2-[2-(methylaminomethyl)piperidin-1-yl]propanamide
CID 63249992
1-[1-(cyclopentylamino)-1-oxopropan-2-yl]-2-methylpiperidine-4-carboxylic acid
CID 106745113
(2R)-N-cyclopentyl-2-[(2R)-2-(5-methoxy-1,3-dimethylpyrazol-4-yl)pyrrolidin-1-yl]propanamide
CID 98767444
(2S)-N-cyclopentyl-2-[(2R)-2-(5-methoxy-1,3-dimethylpyrazol-4-yl)pyrrolidin-1-yl]propanamide
CID 95750877
2-[2-(2-oxocyclopentyl)piperidin-1-yl]-N-propan-2-ylpropanamide
CID 79544722
N-methyl-2-[2-(2-oxocyclohexyl)pyrrolidin-1-yl]propanamide
CID 79546445
N-cyclopentyl-2-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]propanamide
CID 79411085

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-cyclopentylpropanamide?
The IUPAC name of 2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-cyclopentylpropanamide (CID 56781705) is 2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-cyclopentylpropanamide.
What is the SMILES notation for 2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-cyclopentylpropanamide?
The canonical SMILES for 2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-cyclopentylpropanamide is CC(=O)N1CCCC1C1CCCN1C(C)C(=O)NC1CCCC1.
What is the InChIKey of 2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-cyclopentylpropanamide?
The InChIKey is FNPDDYMSXLVMRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31N3O2/c1-13(18(23)19-15-7-3-4-8-15)20-11-5-9-16(20)17-10-6-12-21(17)14(2)22/h13,15-17H,3-12H2,1-2H3,(H,19,23).
What are the key properties of 2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-cyclopentylpropanamide?
2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-cyclopentylpropanamide has a molecular weight of 321.47 g/mol, XLogP of 1.91, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-cyclopentylpropanamide is sourced from PubChem (CID 56781705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).