N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylpyrrolidine-2-carboxamide

C11H17N3O2 — CID 65488157

IUPACN-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylpyrrolidine-2-carboxamide
SMILESCc1noc(NC(=O)C2(C)CCCN2)c1C
InChIInChI=1S/C11H17N3O2/c1-7-8(2)14-16-9(7)13-10(15)11(3)5-4-6-12-11/h12H,4-6H2,1-3H3,(H,13,15)
InChIKeyORWHPSMHEGMRGE-UHFFFAOYSA-N
MW223.28 g/mol
LogP1.37
Rot. Bonds2

About N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylpyrrolidine-2-carboxamide

N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylpyrrolidine-2-carboxamide (PubChem CID 65488157) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylpyrrolidine-2-carboxamide
PubChem CID65488157
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC NameN-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylpyrrolidine-2-carboxamide
SMILESCc1noc(NC(=O)C2(C)CCCN2)c1C
InChIInChI=1S/C11H17N3O2/c1-7-8(2)14-16-9(7)13-10(15)11(3)5-4-6-12-11/h12H,4-6H2,1-3H3,(H,13,15)
InChIKeyORWHPSMHEGMRGE-UHFFFAOYSA-N
XLogP1.37
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylpyrrolidine-2-carboxamide?
The IUPAC name of N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylpyrrolidine-2-carboxamide (CID 65488157) is N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylpyrrolidine-2-carboxamide?
The canonical SMILES for N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylpyrrolidine-2-carboxamide is Cc1noc(NC(=O)C2(C)CCCN2)c1C.
What is the InChIKey of N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylpyrrolidine-2-carboxamide?
The InChIKey is ORWHPSMHEGMRGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-7-8(2)14-16-9(7)13-10(15)11(3)5-4-6-12-11/h12H,4-6H2,1-3H3,(H,13,15).
What are the key properties of N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylpyrrolidine-2-carboxamide?
N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylpyrrolidine-2-carboxamide has a molecular weight of 223.28 g/mol, XLogP of 1.37, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylpyrrolidine-2-carboxamide is sourced from PubChem (CID 65488157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).