N-cyclopentyl-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-2-methylpyrrolidine-2-carboxamide

C17H25N3O3 — CID 110249133

IUPACN-cyclopentyl-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-2-methylpyrrolidine-2-carboxamide
SMILESCc1noc(C)c1C(=O)N1CCCC1(C)C(=O)NC1CCCC1
InChIInChI=1S/C17H25N3O3/c1-11-14(12(2)23-19-11)15(21)20-10-6-9-17(20,3)16(22)18-13-7-4-5-8-13/h13H,4-10H2,1-3H3,(H,18,22)
InChIKeyBVJILMTVVPUUFZ-UHFFFAOYSA-N
MW319.41 g/mol
LogP2.34
Rot. Bonds3

About N-cyclopentyl-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-2-methylpyrrolidine-2-carboxamide

N-cyclopentyl-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-2-methylpyrrolidine-2-carboxamide (PubChem CID 110249133) has the molecular formula C17H25N3O3 and a molecular weight of 319.41 g/mol. Its IUPAC name is N-cyclopentyl-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-2-methylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-2-methylpyrrolidine-2-carboxamide
PubChem CID110249133
Molecular FormulaC17H25N3O3
Molecular Weight319.41 g/mol
Exact Mass319.19
IUPAC NameN-cyclopentyl-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-2-methylpyrrolidine-2-carboxamide
SMILESCc1noc(C)c1C(=O)N1CCCC1(C)C(=O)NC1CCCC1
InChIInChI=1S/C17H25N3O3/c1-11-14(12(2)23-19-11)15(21)20-10-6-9-17(20,3)16(22)18-13-7-4-5-8-13/h13H,4-10H2,1-3H3,(H,18,22)
InChIKeyBVJILMTVVPUUFZ-UHFFFAOYSA-N
XLogP2.34
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-2-methylpyrrolidine-2-carboxamide?
The IUPAC name of N-cyclopentyl-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-2-methylpyrrolidine-2-carboxamide (CID 110249133) is N-cyclopentyl-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-2-methylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-2-methylpyrrolidine-2-carboxamide?
The canonical SMILES for N-cyclopentyl-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-2-methylpyrrolidine-2-carboxamide is Cc1noc(C)c1C(=O)N1CCCC1(C)C(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-2-methylpyrrolidine-2-carboxamide?
The InChIKey is BVJILMTVVPUUFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3/c1-11-14(12(2)23-19-11)15(21)20-10-6-9-17(20,3)16(22)18-13-7-4-5-8-13/h13H,4-10H2,1-3H3,(H,18,22).
What are the key properties of N-cyclopentyl-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-2-methylpyrrolidine-2-carboxamide?
N-cyclopentyl-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-2-methylpyrrolidine-2-carboxamide has a molecular weight of 319.41 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-2-methylpyrrolidine-2-carboxamide is sourced from PubChem (CID 110249133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).