N-[1-(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)azetidin-3-yl]-3-cyclopropyl-1,2-oxazole-5-carboxamide

C20H26N4O4 — CID 154794350

IUPACN-[1-(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)azetidin-3-yl]-3-cyclopropyl-1,2-oxazole-5-carboxamide
SMILESO=C(NC1CN(C(=O)C2CC(=O)N(C3CCCC3)C2)C1)c1cc(C2CC2)no1
InChIInChI=1S/C20H26N4O4/c25-18-7-13(9-24(18)15-3-1-2-4-15)20(27)23-10-14(11-23)21-19(26)17-8-16(22-28-17)12-5-6-12/h8,12-15H,1-7,9-11H2,(H,21,26)
InChIKeyONPWTGHLGXICAL-UHFFFAOYSA-N
MW386.45 g/mol
LogP1.28
Rot. Bonds5

About N-[1-(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)azetidin-3-yl]-3-cyclopropyl-1,2-oxazole-5-carboxamide

N-[1-(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)azetidin-3-yl]-3-cyclopropyl-1,2-oxazole-5-carboxamide (PubChem CID 154794350) has the molecular formula C20H26N4O4 and a molecular weight of 386.45 g/mol. Its IUPAC name is N-[1-(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)azetidin-3-yl]-3-cyclopropyl-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-[1-(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)azetidin-3-yl]-3-cyclopropyl-1,2-oxazole-5-carboxamide
PubChem CID154794350
Molecular FormulaC20H26N4O4
Molecular Weight386.45 g/mol
Exact Mass386.20
IUPAC NameN-[1-(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)azetidin-3-yl]-3-cyclopropyl-1,2-oxazole-5-carboxamide
SMILESO=C(NC1CN(C(=O)C2CC(=O)N(C3CCCC3)C2)C1)c1cc(C2CC2)no1
InChIInChI=1S/C20H26N4O4/c25-18-7-13(9-24(18)15-3-1-2-4-15)20(27)23-10-14(11-23)21-19(26)17-8-16(22-28-17)12-5-6-12/h8,12-15H,1-7,9-11H2,(H,21,26)
InChIKeyONPWTGHLGXICAL-UHFFFAOYSA-N
XLogP1.28
TPSA95.75 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)azetidin-3-yl]-3-cyclopropyl-1,2-oxazole-5-carboxamide?
The IUPAC name of N-[1-(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)azetidin-3-yl]-3-cyclopropyl-1,2-oxazole-5-carboxamide (CID 154794350) is N-[1-(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)azetidin-3-yl]-3-cyclopropyl-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-[1-(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)azetidin-3-yl]-3-cyclopropyl-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-[1-(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)azetidin-3-yl]-3-cyclopropyl-1,2-oxazole-5-carboxamide is O=C(NC1CN(C(=O)C2CC(=O)N(C3CCCC3)C2)C1)c1cc(C2CC2)no1.
What is the InChIKey of N-[1-(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)azetidin-3-yl]-3-cyclopropyl-1,2-oxazole-5-carboxamide?
The InChIKey is ONPWTGHLGXICAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O4/c25-18-7-13(9-24(18)15-3-1-2-4-15)20(27)23-10-14(11-23)21-19(26)17-8-16(22-28-17)12-5-6-12/h8,12-15H,1-7,9-11H2,(H,21,26).
What are the key properties of N-[1-(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)azetidin-3-yl]-3-cyclopropyl-1,2-oxazole-5-carboxamide?
N-[1-(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)azetidin-3-yl]-3-cyclopropyl-1,2-oxazole-5-carboxamide has a molecular weight of 386.45 g/mol, XLogP of 1.28, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)azetidin-3-yl]-3-cyclopropyl-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 154794350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).