5-(1-methylcyclopropyl)-2-pyrrolidin-3-yl-1,3-oxazole

C11H16N2O — CID 115019177

IUPAC5-(1-methylcyclopropyl)-2-pyrrolidin-3-yl-1,3-oxazole
SMILESCC1(c2cnc(C3CCNC3)o2)CC1
InChIInChI=1S/C11H16N2O/c1-11(3-4-11)9-7-13-10(14-9)8-2-5-12-6-8/h7-8,12H,2-6H2,1H3
InChIKeyMLPGUNIRZUZLDM-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.80
Rot. Bonds2

About 5-(1-methylcyclopropyl)-2-pyrrolidin-3-yl-1,3-oxazole

5-(1-methylcyclopropyl)-2-pyrrolidin-3-yl-1,3-oxazole (PubChem CID 115019177) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 5-(1-methylcyclopropyl)-2-pyrrolidin-3-yl-1,3-oxazole.

Molecular Properties

Compound Name5-(1-methylcyclopropyl)-2-pyrrolidin-3-yl-1,3-oxazole
PubChem CID115019177
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name5-(1-methylcyclopropyl)-2-pyrrolidin-3-yl-1,3-oxazole
SMILESCC1(c2cnc(C3CCNC3)o2)CC1
InChIInChI=1S/C11H16N2O/c1-11(3-4-11)9-7-13-10(14-9)8-2-5-12-6-8/h7-8,12H,2-6H2,1H3
InChIKeyMLPGUNIRZUZLDM-UHFFFAOYSA-N
XLogP1.80
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(1-methylcyclohexyl)-2-pyrrolidin-3-yl-1,3-oxazole
CID 115040326
5-cyclohexyl-2-pyrrolidin-3-yl-1,3-oxazole
CID 84685995
2-(azetidin-3-yl)-5-piperidin-4-yl-1,3-oxazole
CID 115025282
2-(2-pyrrolidin-3-yl-1,3-oxazol-5-yl)acetaldehyde
CID 115084955
5-(3-bromophenyl)-2-pyrrolidin-3-yl-1,3-oxazole
CID 84715623
2-(2-pyrrolidin-3-yl-1,3-oxazol-5-yl)phenol
CID 84693433
5-pyrrolidin-3-yl-1,2,4-oxadiazole
CID 54573513
2-piperidin-3-yl-1,3-oxazole-5-carbaldehyde
CID 115085525
3-(4,4-dimethylcyclohexyl)-5-pyrrolidin-3-yl-1,2,4-oxadiazole
CID 65390962
3-(3-methyloxolan-3-yl)-5-pyrrolidin-3-yl-1,2,4-oxadiazole
CID 115033888
2-ethyl-5-[(3S)-pyrrolidin-3-yl]-1,3,4-oxadiazole
CID 124673400
5-(azetidin-3-yl)-2-cyclopentyl-1,3-oxazole
CID 105446346

Frequently Asked Questions

What is the IUPAC name of 5-(1-methylcyclopropyl)-2-pyrrolidin-3-yl-1,3-oxazole?
The IUPAC name of 5-(1-methylcyclopropyl)-2-pyrrolidin-3-yl-1,3-oxazole (CID 115019177) is 5-(1-methylcyclopropyl)-2-pyrrolidin-3-yl-1,3-oxazole.
What is the SMILES notation for 5-(1-methylcyclopropyl)-2-pyrrolidin-3-yl-1,3-oxazole?
The canonical SMILES for 5-(1-methylcyclopropyl)-2-pyrrolidin-3-yl-1,3-oxazole is CC1(c2cnc(C3CCNC3)o2)CC1.
What is the InChIKey of 5-(1-methylcyclopropyl)-2-pyrrolidin-3-yl-1,3-oxazole?
The InChIKey is MLPGUNIRZUZLDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-11(3-4-11)9-7-13-10(14-9)8-2-5-12-6-8/h7-8,12H,2-6H2,1H3.
What are the key properties of 5-(1-methylcyclopropyl)-2-pyrrolidin-3-yl-1,3-oxazole?
5-(1-methylcyclopropyl)-2-pyrrolidin-3-yl-1,3-oxazole has a molecular weight of 192.26 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methylcyclopropyl)-2-pyrrolidin-3-yl-1,3-oxazole is sourced from PubChem (CID 115019177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).