(2R)-2-(1,2-oxazol-3-yl)-N-pyridin-3-ylpyrrolidine-1-carboxamide

C13H14N4O2 — CID 166296927

IUPAC(2R)-2-(1,2-oxazol-3-yl)-N-pyridin-3-ylpyrrolidine-1-carboxamide
SMILESO=C(Nc1cccnc1)N1CCC[C@@H]1c1ccon1
InChIInChI=1S/C13H14N4O2/c18-13(15-10-3-1-6-14-9-10)17-7-2-4-12(17)11-5-8-19-16-11/h1,3,5-6,8-9,12H,2,4,7H2,(H,15,18)/t12-/m1/s1
InChIKeyJRZPQKZAFVGZAT-GFCCVEGCSA-N
MW258.28 g/mol
LogP2.44
Rot. Bonds2

About (2R)-2-(1,2-oxazol-3-yl)-N-pyridin-3-ylpyrrolidine-1-carboxamide

(2R)-2-(1,2-oxazol-3-yl)-N-pyridin-3-ylpyrrolidine-1-carboxamide (PubChem CID 166296927) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is (2R)-2-(1,2-oxazol-3-yl)-N-pyridin-3-ylpyrrolidine-1-carboxamide.

Molecular Properties

Compound Name(2R)-2-(1,2-oxazol-3-yl)-N-pyridin-3-ylpyrrolidine-1-carboxamide
PubChem CID166296927
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC Name(2R)-2-(1,2-oxazol-3-yl)-N-pyridin-3-ylpyrrolidine-1-carboxamide
SMILESO=C(Nc1cccnc1)N1CCC[C@@H]1c1ccon1
InChIInChI=1S/C13H14N4O2/c18-13(15-10-3-1-6-14-9-10)17-7-2-4-12(17)11-5-8-19-16-11/h1,3,5-6,8-9,12H,2,4,7H2,(H,15,18)/t12-/m1/s1
InChIKeyJRZPQKZAFVGZAT-GFCCVEGCSA-N
XLogP2.44
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-pyridin-3-ylpyrrolidine-1-carboxamide
CID 162666113
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-pyridin-3-ylpyrrolidine-1-carboxamide
CID 18101804
(2S)-N-(5-methylsulfanyl-2-pyridinyl)-2-(1,2-oxazol-3-yl)pyrrolidine-1-carboxamide
CID 146149715
[(2R,3S)-3-methyloxiran-2-yl]-[(2R)-2-(1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone
CID 166418365
(2R)-2-(2,4-dimethoxyphenyl)-N-pyridin-3-ylpyrrolidine-1-carboxamide
CID 92800272
(2S)-2-(2,4-dimethoxyphenyl)-N-pyridin-3-ylpyrrolidine-1-carboxamide
CID 92800271
N-(3-chlorophenyl)-2-pyridin-3-ylpiperidine-1-carboxamide
CID 3751158
(2S)-1-acetyl-N-pyridin-3-ylpyrrolidine-2-carboxamide
CID 51089557
(2R)-N-phenyl-2-(5-propan-2-yl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide
CID 93070295
2-(5-methyl-1,2-oxazol-3-yl)-N-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)pyrrolidine-1-carboxamide
CID 118779738
N-pyridin-3-yl-3-pyrrolidin-1-ylpiperidine-1-carboxamide
CID 47050086
N-(4-chlorophenyl)-2-pyridin-2-ylpyrrolidine-1-carboxamide
CID 110874700

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(1,2-oxazol-3-yl)-N-pyridin-3-ylpyrrolidine-1-carboxamide?
The IUPAC name of (2R)-2-(1,2-oxazol-3-yl)-N-pyridin-3-ylpyrrolidine-1-carboxamide (CID 166296927) is (2R)-2-(1,2-oxazol-3-yl)-N-pyridin-3-ylpyrrolidine-1-carboxamide.
What is the SMILES notation for (2R)-2-(1,2-oxazol-3-yl)-N-pyridin-3-ylpyrrolidine-1-carboxamide?
The canonical SMILES for (2R)-2-(1,2-oxazol-3-yl)-N-pyridin-3-ylpyrrolidine-1-carboxamide is O=C(Nc1cccnc1)N1CCC[C@@H]1c1ccon1.
What is the InChIKey of (2R)-2-(1,2-oxazol-3-yl)-N-pyridin-3-ylpyrrolidine-1-carboxamide?
The InChIKey is JRZPQKZAFVGZAT-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H14N4O2/c18-13(15-10-3-1-6-14-9-10)17-7-2-4-12(17)11-5-8-19-16-11/h1,3,5-6,8-9,12H,2,4,7H2,(H,15,18)/t12-/m1/s1.
What are the key properties of (2R)-2-(1,2-oxazol-3-yl)-N-pyridin-3-ylpyrrolidine-1-carboxamide?
(2R)-2-(1,2-oxazol-3-yl)-N-pyridin-3-ylpyrrolidine-1-carboxamide has a molecular weight of 258.28 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(1,2-oxazol-3-yl)-N-pyridin-3-ylpyrrolidine-1-carboxamide is sourced from PubChem (CID 166296927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).