N-cyclopentyl-1-(3-imidazol-1-ylpropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide

C17H26N4O2 — CID 51361555

IUPACN-cyclopentyl-1-(3-imidazol-1-ylpropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide
SMILESCC1(C(=O)NC2CCCC2)CCC(=O)N1CCCn1ccnc1
InChIInChI=1S/C17H26N4O2/c1-17(16(23)19-14-5-2-3-6-14)8-7-15(22)21(17)11-4-10-20-12-9-18-13-20/h9,12-14H,2-8,10-11H2,1H3,(H,19,23)
InChIKeyRPNHLISOMZWLIJ-UHFFFAOYSA-N
MW318.42 g/mol
LogP1.71
Rot. Bonds6

About N-cyclopentyl-1-(3-imidazol-1-ylpropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide

N-cyclopentyl-1-(3-imidazol-1-ylpropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide (PubChem CID 51361555) has the molecular formula C17H26N4O2 and a molecular weight of 318.42 g/mol. Its IUPAC name is N-cyclopentyl-1-(3-imidazol-1-ylpropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1-(3-imidazol-1-ylpropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide
PubChem CID51361555
Molecular FormulaC17H26N4O2
Molecular Weight318.42 g/mol
Exact Mass318.21
IUPAC NameN-cyclopentyl-1-(3-imidazol-1-ylpropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide
SMILESCC1(C(=O)NC2CCCC2)CCC(=O)N1CCCn1ccnc1
InChIInChI=1S/C17H26N4O2/c1-17(16(23)19-14-5-2-3-6-14)8-7-15(22)21(17)11-4-10-20-12-9-18-13-20/h9,12-14H,2-8,10-11H2,1H3,(H,19,23)
InChIKeyRPNHLISOMZWLIJ-UHFFFAOYSA-N
XLogP1.71
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(3-imidazol-1-ylpropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of N-cyclopentyl-1-(3-imidazol-1-ylpropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide (CID 51361555) is N-cyclopentyl-1-(3-imidazol-1-ylpropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-1-(3-imidazol-1-ylpropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for N-cyclopentyl-1-(3-imidazol-1-ylpropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide is CC1(C(=O)NC2CCCC2)CCC(=O)N1CCCn1ccnc1.
What is the InChIKey of N-cyclopentyl-1-(3-imidazol-1-ylpropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide?
The InChIKey is RPNHLISOMZWLIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O2/c1-17(16(23)19-14-5-2-3-6-14)8-7-15(22)21(17)11-4-10-20-12-9-18-13-20/h9,12-14H,2-8,10-11H2,1H3,(H,19,23).
What are the key properties of N-cyclopentyl-1-(3-imidazol-1-ylpropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide?
N-cyclopentyl-1-(3-imidazol-1-ylpropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide has a molecular weight of 318.42 g/mol, XLogP of 1.71, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(3-imidazol-1-ylpropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 51361555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).