N-(2-methoxyethyl)-N-[(3-phenyl-5-pyrrolidin-1-yl-1,2-oxazol-4-yl)methyl]acetamide

C19H25N3O3 — CID 24716532

IUPACN-(2-methoxyethyl)-N-[(3-phenyl-5-pyrrolidin-1-yl-1,2-oxazol-4-yl)methyl]acetamide
SMILESCOCCN(Cc1c(-c2ccccc2)noc1N1CCCC1)C(C)=O
InChIInChI=1S/C19H25N3O3/c1-15(23)22(12-13-24-2)14-17-18(16-8-4-3-5-9-16)20-25-19(17)21-10-6-7-11-21/h3-5,8-9H,6-7,10-14H2,1-2H3
InChIKeyBYMGWVPJWACPDZ-UHFFFAOYSA-N
MW343.43 g/mol
LogP2.94
Rot. Bonds7

About N-(2-methoxyethyl)-N-[(3-phenyl-5-pyrrolidin-1-yl-1,2-oxazol-4-yl)methyl]acetamide

N-(2-methoxyethyl)-N-[(3-phenyl-5-pyrrolidin-1-yl-1,2-oxazol-4-yl)methyl]acetamide (PubChem CID 24716532) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-[(3-phenyl-5-pyrrolidin-1-yl-1,2-oxazol-4-yl)methyl]acetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-[(3-phenyl-5-pyrrolidin-1-yl-1,2-oxazol-4-yl)methyl]acetamide
PubChem CID24716532
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC NameN-(2-methoxyethyl)-N-[(3-phenyl-5-pyrrolidin-1-yl-1,2-oxazol-4-yl)methyl]acetamide
SMILESCOCCN(Cc1c(-c2ccccc2)noc1N1CCCC1)C(C)=O
InChIInChI=1S/C19H25N3O3/c1-15(23)22(12-13-24-2)14-17-18(16-8-4-3-5-9-16)20-25-19(17)21-10-6-7-11-21/h3-5,8-9H,6-7,10-14H2,1-2H3
InChIKeyBYMGWVPJWACPDZ-UHFFFAOYSA-N
XLogP2.94
TPSA58.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-[(3-phenyl-5-pyrrolidin-1-yl-1,2-oxazol-4-yl)methyl]acetamide?
The IUPAC name of N-(2-methoxyethyl)-N-[(3-phenyl-5-pyrrolidin-1-yl-1,2-oxazol-4-yl)methyl]acetamide (CID 24716532) is N-(2-methoxyethyl)-N-[(3-phenyl-5-pyrrolidin-1-yl-1,2-oxazol-4-yl)methyl]acetamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-[(3-phenyl-5-pyrrolidin-1-yl-1,2-oxazol-4-yl)methyl]acetamide?
The canonical SMILES for N-(2-methoxyethyl)-N-[(3-phenyl-5-pyrrolidin-1-yl-1,2-oxazol-4-yl)methyl]acetamide is COCCN(Cc1c(-c2ccccc2)noc1N1CCCC1)C(C)=O.
What is the InChIKey of N-(2-methoxyethyl)-N-[(3-phenyl-5-pyrrolidin-1-yl-1,2-oxazol-4-yl)methyl]acetamide?
The InChIKey is BYMGWVPJWACPDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-15(23)22(12-13-24-2)14-17-18(16-8-4-3-5-9-16)20-25-19(17)21-10-6-7-11-21/h3-5,8-9H,6-7,10-14H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-N-[(3-phenyl-5-pyrrolidin-1-yl-1,2-oxazol-4-yl)methyl]acetamide?
N-(2-methoxyethyl)-N-[(3-phenyl-5-pyrrolidin-1-yl-1,2-oxazol-4-yl)methyl]acetamide has a molecular weight of 343.43 g/mol, XLogP of 2.94, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-[(3-phenyl-5-pyrrolidin-1-yl-1,2-oxazol-4-yl)methyl]acetamide is sourced from PubChem (CID 24716532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).