6-oxo-N-pyrrolidin-3-ylpyran-3-carboxamide

C10H12N2O3 — CID 62379515

IUPAC6-oxo-N-pyrrolidin-3-ylpyran-3-carboxamide
SMILESO=C(NC1CCNC1)c1ccc(=O)oc1
InChIInChI=1S/C10H12N2O3/c13-9-2-1-7(6-15-9)10(14)12-8-3-4-11-5-8/h1-2,6,8,11H,3-5H2,(H,12,14)
InChIKeyDEBZNNKLWMVQMW-UHFFFAOYSA-N
MW208.22 g/mol
LogP-0.27
Rot. Bonds2

About 6-oxo-N-pyrrolidin-3-ylpyran-3-carboxamide

6-oxo-N-pyrrolidin-3-ylpyran-3-carboxamide (PubChem CID 62379515) has the molecular formula C10H12N2O3 and a molecular weight of 208.22 g/mol. Its IUPAC name is 6-oxo-N-pyrrolidin-3-ylpyran-3-carboxamide.

Molecular Properties

Compound Name6-oxo-N-pyrrolidin-3-ylpyran-3-carboxamide
PubChem CID62379515
Molecular FormulaC10H12N2O3
Molecular Weight208.22 g/mol
Exact Mass208.08
IUPAC Name6-oxo-N-pyrrolidin-3-ylpyran-3-carboxamide
SMILESO=C(NC1CCNC1)c1ccc(=O)oc1
InChIInChI=1S/C10H12N2O3/c13-9-2-1-7(6-15-9)10(14)12-8-3-4-11-5-8/h1-2,6,8,11H,3-5H2,(H,12,14)
InChIKeyDEBZNNKLWMVQMW-UHFFFAOYSA-N
XLogP-0.27
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-aminocyclohexyl)-6-oxopyran-3-carboxamide
CID 79113506
4-acetyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119449499
4-hydroxy-N-[(3S)-pyrrolidin-3-yl]benzamide
CID 79689032
N-(3-aminocyclobutyl)-6-oxopyran-3-carboxamide
CID 43594945
4-chloro-N-[(3R)-pyrrolidin-3-yl]benzamide
CID 79685775
4-bromo-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119453836
N-pyrrolidin-3-yl-4-pyrrol-1-ylbenzamide
CID 82176966
1-methyl-N-pyrrolidin-3-ylpyrrole-3-carboxamide
CID 83619398
3,4-dihydroxy-N-[(3S)-pyrrolidin-3-yl]benzamide
CID 107728777
N-cyclopropyl-4-(pyrrolidin-3-ylamino)benzamide
CID 79724165
4-ethyl-N-[(3S)-pyrrolidin-3-yl]benzamide
CID 79689710
N-[(3R)-pyrrolidin-3-yl]-1,3-benzodioxole-5-carboxamide
CID 71645351

Frequently Asked Questions

What is the IUPAC name of 6-oxo-N-pyrrolidin-3-ylpyran-3-carboxamide?
The IUPAC name of 6-oxo-N-pyrrolidin-3-ylpyran-3-carboxamide (CID 62379515) is 6-oxo-N-pyrrolidin-3-ylpyran-3-carboxamide.
What is the SMILES notation for 6-oxo-N-pyrrolidin-3-ylpyran-3-carboxamide?
The canonical SMILES for 6-oxo-N-pyrrolidin-3-ylpyran-3-carboxamide is O=C(NC1CCNC1)c1ccc(=O)oc1.
What is the InChIKey of 6-oxo-N-pyrrolidin-3-ylpyran-3-carboxamide?
The InChIKey is DEBZNNKLWMVQMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O3/c13-9-2-1-7(6-15-9)10(14)12-8-3-4-11-5-8/h1-2,6,8,11H,3-5H2,(H,12,14).
What are the key properties of 6-oxo-N-pyrrolidin-3-ylpyran-3-carboxamide?
6-oxo-N-pyrrolidin-3-ylpyran-3-carboxamide has a molecular weight of 208.22 g/mol, XLogP of -0.27, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-N-pyrrolidin-3-ylpyran-3-carboxamide is sourced from PubChem (CID 62379515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).