N-pyrrolidin-3-yl-1,2-oxazole-3-carboxamide

C8H11N3O2 — CID 62378974

IUPACN-pyrrolidin-3-yl-1,2-oxazole-3-carboxamide
SMILESO=C(NC1CCNC1)c1ccon1
InChIInChI=1S/C8H11N3O2/c12-8(7-2-4-13-11-7)10-6-1-3-9-5-6/h2,4,6,9H,1,3,5H2,(H,10,12)
InChIKeyJSSKDYRRUOKIHM-UHFFFAOYSA-N
MW181.19 g/mol
LogP-0.23
Rot. Bonds2

About N-pyrrolidin-3-yl-1,2-oxazole-3-carboxamide

N-pyrrolidin-3-yl-1,2-oxazole-3-carboxamide (PubChem CID 62378974) has the molecular formula C8H11N3O2 and a molecular weight of 181.19 g/mol. Its IUPAC name is N-pyrrolidin-3-yl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-pyrrolidin-3-yl-1,2-oxazole-3-carboxamide
PubChem CID62378974
Molecular FormulaC8H11N3O2
Molecular Weight181.19 g/mol
Exact Mass181.09
IUPAC NameN-pyrrolidin-3-yl-1,2-oxazole-3-carboxamide
SMILESO=C(NC1CCNC1)c1ccon1
InChIInChI=1S/C8H11N3O2/c12-8(7-2-4-13-11-7)10-6-1-3-9-5-6/h2,4,6,9H,1,3,5H2,(H,10,12)
InChIKeyJSSKDYRRUOKIHM-UHFFFAOYSA-N
XLogP-0.23
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.19
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylpiperidin-4-yl)-1,2-oxazole-3-carboxamide;hydrochloride
CID 120600756
2-amino-N-pyrrolidin-3-ylpyrimidine-4-carboxamide
CID 142582873
1-methyl-N-[(3S)-pyrrolidin-3-yl]pyrazole-3-carboxamide
CID 103120955
3,7-diazabicyclo[4.2.0]octan-7-yl(1,2-oxazol-3-yl)methanone
CID 68600950
N-[(3R)-pyrrolidin-3-yl]-1,2,5-thiadiazole-3-carboxamide
CID 79685297
N-(3-imidazol-1-ylcyclobutyl)-1,2-oxazole-3-carboxamide
CID 126648400
6-methyl-N-pyrrolidin-3-ylpyridine-2-carboxamide;dihydrochloride
CID 119451522
2-phenyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide
CID 119453994
N-pyrrolidin-3-ylquinoxaline-2-carboxamide
CID 113265403
2-(furan-3-yl)-N-[(3S)-piperidin-3-yl]-1,3-thiazole-4-carboxamide;dihydrochloride
CID 126776233
4-hydroxy-N-[(3S)-pyrrolidin-3-yl]benzamide
CID 79689032
4,6-dimethyl-N-pyrrolidin-3-ylpyridine-2-carboxamide
CID 166178324

Frequently Asked Questions

What is the IUPAC name of N-pyrrolidin-3-yl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-pyrrolidin-3-yl-1,2-oxazole-3-carboxamide (CID 62378974) is N-pyrrolidin-3-yl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-pyrrolidin-3-yl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-pyrrolidin-3-yl-1,2-oxazole-3-carboxamide is O=C(NC1CCNC1)c1ccon1.
What is the InChIKey of N-pyrrolidin-3-yl-1,2-oxazole-3-carboxamide?
The InChIKey is JSSKDYRRUOKIHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O2/c12-8(7-2-4-13-11-7)10-6-1-3-9-5-6/h2,4,6,9H,1,3,5H2,(H,10,12).
What are the key properties of N-pyrrolidin-3-yl-1,2-oxazole-3-carboxamide?
N-pyrrolidin-3-yl-1,2-oxazole-3-carboxamide has a molecular weight of 181.19 g/mol, XLogP of -0.23, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyrrolidin-3-yl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 62378974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).