N-[1-(cyclopentanecarbonyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide

C16H25N3O3 — CID 110820011

IUPACN-[1-(cyclopentanecarbonyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide
SMILESO=C1CCC(C(=O)NC2CCN(C(=O)C3CCCC3)CC2)N1
InChIInChI=1S/C16H25N3O3/c20-14-6-5-13(18-14)15(21)17-12-7-9-19(10-8-12)16(22)11-3-1-2-4-11/h11-13H,1-10H2,(H,17,21)(H,18,20)
InChIKeyOVPPCJCDYFTXPH-UHFFFAOYSA-N
MW307.39 g/mol
LogP0.56
Rot. Bonds3

About N-[1-(cyclopentanecarbonyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide

N-[1-(cyclopentanecarbonyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide (PubChem CID 110820011) has the molecular formula C16H25N3O3 and a molecular weight of 307.39 g/mol. Its IUPAC name is N-[1-(cyclopentanecarbonyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(cyclopentanecarbonyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide
PubChem CID110820011
Molecular FormulaC16H25N3O3
Molecular Weight307.39 g/mol
Exact Mass307.19
IUPAC NameN-[1-(cyclopentanecarbonyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide
SMILESO=C1CCC(C(=O)NC2CCN(C(=O)C3CCCC3)CC2)N1
InChIInChI=1S/C16H25N3O3/c20-14-6-5-13(18-14)15(21)17-12-7-9-19(10-8-12)16(22)11-3-1-2-4-11/h11-13H,1-10H2,(H,17,21)(H,18,20)
InChIKeyOVPPCJCDYFTXPH-UHFFFAOYSA-N
XLogP0.56
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide
CID 110821301
(5R)-5-(pyrrolidine-1-carbonyl)pyrrolidin-2-one
CID 45116190
N-[1-(2-ethylbutanoyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide
CID 110820091
(2R)-5-oxo-N-piperidin-4-ylpyrrolidine-2-carboxamide
CID 93299792
1-(cyclohexanecarbonyl)-N-cyclopentylpiperidine-4-carboxamide
CID 113002958
N-[4-(methylamino)cyclohexyl]-5-oxopyrrolidine-2-carboxamide
CID 79110439
1-[1-(cyclopentanecarbonyl)piperidin-4-yl]-3-cyclopentylurea
CID 110820027
(2R)-N-(4-methylcyclohexyl)-5-oxopyrrolidine-2-carboxamide
CID 127296472
(2S)-5-oxo-N-[(3S)-pyrrolidin-3-yl]pyrrolidine-2-carboxamide
CID 93216020
(2R)-5-oxo-N-piperidin-3-ylpyrrolidine-2-carboxamide
CID 103805383
N-[1-(2-fluorobenzoyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide
CID 110820368
N-[(3R)-1-(cyclopentanecarbonyl)pyrrolidin-3-yl]cyclopentanecarboxamide
CID 95051673

Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclopentanecarbonyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of N-[1-(cyclopentanecarbonyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide (CID 110820011) is N-[1-(cyclopentanecarbonyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for N-[1-(cyclopentanecarbonyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for N-[1-(cyclopentanecarbonyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide is O=C1CCC(C(=O)NC2CCN(C(=O)C3CCCC3)CC2)N1.
What is the InChIKey of N-[1-(cyclopentanecarbonyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide?
The InChIKey is OVPPCJCDYFTXPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O3/c20-14-6-5-13(18-14)15(21)17-12-7-9-19(10-8-12)16(22)11-3-1-2-4-11/h11-13H,1-10H2,(H,17,21)(H,18,20).
What are the key properties of N-[1-(cyclopentanecarbonyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide?
N-[1-(cyclopentanecarbonyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide has a molecular weight of 307.39 g/mol, XLogP of 0.56, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclopentanecarbonyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 110820011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).