[3-[5-[1-(2-methoxyethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]azetidin-1-yl]-(3-methyl-2-pyridinyl)methanone

C19H25N5O3 — CID 91921589

IUPAC[3-[5-[1-(2-methoxyethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]azetidin-1-yl]-(3-methyl-2-pyridinyl)methanone
SMILESCOCCN1CCCC1c1nc(C2CN(C(=O)c3ncccc3C)C2)no1
InChIInChI=1S/C19H25N5O3/c1-13-5-3-7-20-16(13)19(25)24-11-14(12-24)17-21-18(27-22-17)15-6-4-8-23(15)9-10-26-2/h3,5,7,14-15H,4,6,8-12H2,1-2H3
InChIKeyWVOWKYZDGVUHSE-UHFFFAOYSA-N
MW371.44 g/mol
LogP1.80
Rot. Bonds6

About [3-[5-[1-(2-methoxyethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]azetidin-1-yl]-(3-methyl-2-pyridinyl)methanone

[3-[5-[1-(2-methoxyethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]azetidin-1-yl]-(3-methyl-2-pyridinyl)methanone (PubChem CID 91921589) has the molecular formula C19H25N5O3 and a molecular weight of 371.44 g/mol. Its IUPAC name is [3-[5-[1-(2-methoxyethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]azetidin-1-yl]-(3-methyl-2-pyridinyl)methanone.

Molecular Properties

Compound Name[3-[5-[1-(2-methoxyethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]azetidin-1-yl]-(3-methyl-2-pyridinyl)methanone
PubChem CID91921589
Molecular FormulaC19H25N5O3
Molecular Weight371.44 g/mol
Exact Mass371.20
IUPAC Name[3-[5-[1-(2-methoxyethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]azetidin-1-yl]-(3-methyl-2-pyridinyl)methanone
SMILESCOCCN1CCCC1c1nc(C2CN(C(=O)c3ncccc3C)C2)no1
InChIInChI=1S/C19H25N5O3/c1-13-5-3-7-20-16(13)19(25)24-11-14(12-24)17-21-18(27-22-17)15-6-4-8-23(15)9-10-26-2/h3,5,7,14-15H,4,6,8-12H2,1-2H3
InChIKeyWVOWKYZDGVUHSE-UHFFFAOYSA-N
XLogP1.80
TPSA84.59 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze [3-[5-[1-(2-methoxyethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]azetidin-1-yl]-(3-methyl-2-pyridinyl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [3-[5-[1-(2-methoxyethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]azetidin-1-yl]-(3-methyl-2-pyridinyl)methanone?
The IUPAC name of [3-[5-[1-(2-methoxyethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]azetidin-1-yl]-(3-methyl-2-pyridinyl)methanone (CID 91921589) is [3-[5-[1-(2-methoxyethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]azetidin-1-yl]-(3-methyl-2-pyridinyl)methanone.
What is the SMILES notation for [3-[5-[1-(2-methoxyethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]azetidin-1-yl]-(3-methyl-2-pyridinyl)methanone?
The canonical SMILES for [3-[5-[1-(2-methoxyethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]azetidin-1-yl]-(3-methyl-2-pyridinyl)methanone is COCCN1CCCC1c1nc(C2CN(C(=O)c3ncccc3C)C2)no1.
What is the InChIKey of [3-[5-[1-(2-methoxyethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]azetidin-1-yl]-(3-methyl-2-pyridinyl)methanone?
The InChIKey is WVOWKYZDGVUHSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O3/c1-13-5-3-7-20-16(13)19(25)24-11-14(12-24)17-21-18(27-22-17)15-6-4-8-23(15)9-10-26-2/h3,5,7,14-15H,4,6,8-12H2,1-2H3.
What are the key properties of [3-[5-[1-(2-methoxyethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]azetidin-1-yl]-(3-methyl-2-pyridinyl)methanone?
[3-[5-[1-(2-methoxyethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]azetidin-1-yl]-(3-methyl-2-pyridinyl)methanone has a molecular weight of 371.44 g/mol, XLogP of 1.80, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[5-[1-(2-methoxyethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]azetidin-1-yl]-(3-methyl-2-pyridinyl)methanone is sourced from PubChem (CID 91921589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).