N-(1,3-oxazol-4-yl)pyrrolidine-1-carboxamide

C8H11N3O2 — CID 130667375

IUPACN-(1,3-oxazol-4-yl)pyrrolidine-1-carboxamide
SMILESO=C(Nc1cocn1)N1CCCC1
InChIInChI=1S/C8H11N3O2/c12-8(11-3-1-2-4-11)10-7-5-13-6-9-7/h5-6H,1-4H2,(H,10,12)
InChIKeyJSGJOIKESTZTBB-UHFFFAOYSA-N
MW181.19 g/mol
LogP1.30
Rot. Bonds1

About N-(1,3-oxazol-4-yl)pyrrolidine-1-carboxamide

N-(1,3-oxazol-4-yl)pyrrolidine-1-carboxamide (PubChem CID 130667375) has the molecular formula C8H11N3O2 and a molecular weight of 181.19 g/mol. Its IUPAC name is N-(1,3-oxazol-4-yl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(1,3-oxazol-4-yl)pyrrolidine-1-carboxamide
PubChem CID130667375
Molecular FormulaC8H11N3O2
Molecular Weight181.19 g/mol
Exact Mass181.09
IUPAC NameN-(1,3-oxazol-4-yl)pyrrolidine-1-carboxamide
SMILESO=C(Nc1cocn1)N1CCCC1
InChIInChI=1S/C8H11N3O2/c12-8(11-3-1-2-4-11)10-7-5-13-6-9-7/h5-6H,1-4H2,(H,10,12)
InChIKeyJSGJOIKESTZTBB-UHFFFAOYSA-N
XLogP1.30
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.19
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-pyrazin-2-ylpyrrolidine-1-carboxamide
CID 110492109
N-pyrazin-2-ylazepane-1-carboxamide
CID 110492146
N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide
CID 108887313
N-(4-bromo-2-pyridinyl)piperidine-1-carboxamide
CID 102820657
N-(4-methyl-2-pyridinyl)azepane-1-carboxamide
CID 127514123
N-(cyclopropen-1-yl)pyrrolidine-1-carboxamide
CID 175335341
N-(5-cyano-2-pyridinyl)azocane-1-carboxamide
CID 126839121
N-(4-methyl-1,3-oxazol-2-yl)piperidine-1-carboxamide
CID 116658004
N-(4-methyl-1,3-oxazol-2-yl)azepane-1-carboxamide
CID 115671093
N-pyrimidin-5-ylpyrrolidine-1-carboxamide
CID 104859346
N-[5-(hydroxymethyl)-1,3-thiazol-2-yl]pyrrolidine-1-carboxamide
CID 87638926
N-(1-methylpyrazol-3-yl)azetidine-1-carboxamide
CID 131036172

Frequently Asked Questions

What is the IUPAC name of N-(1,3-oxazol-4-yl)pyrrolidine-1-carboxamide?
The IUPAC name of N-(1,3-oxazol-4-yl)pyrrolidine-1-carboxamide (CID 130667375) is N-(1,3-oxazol-4-yl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-(1,3-oxazol-4-yl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-(1,3-oxazol-4-yl)pyrrolidine-1-carboxamide is O=C(Nc1cocn1)N1CCCC1.
What is the InChIKey of N-(1,3-oxazol-4-yl)pyrrolidine-1-carboxamide?
The InChIKey is JSGJOIKESTZTBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O2/c12-8(11-3-1-2-4-11)10-7-5-13-6-9-7/h5-6H,1-4H2,(H,10,12).
What are the key properties of N-(1,3-oxazol-4-yl)pyrrolidine-1-carboxamide?
N-(1,3-oxazol-4-yl)pyrrolidine-1-carboxamide has a molecular weight of 181.19 g/mol, XLogP of 1.30, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-oxazol-4-yl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 130667375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).