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

C17H25N5O3 — CID 71872471

IUPACN-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[1-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]pyrrolidin-3-yl]acetamide
SMILESCC(=O)N(Cc1noc(C)n1)C1CCN(Cc2ncc(C(C)C)o2)C1
InChIInChI=1S/C17H25N5O3/c1-11(2)15-7-18-17(24-15)10-21-6-5-14(8-21)22(13(4)23)9-16-19-12(3)25-20-16/h7,11,14H,5-6,8-10H2,1-4H3
InChIKeyAGJBNQJGKHPYGY-UHFFFAOYSA-N
MW347.42 g/mol
LogP2.11
Rot. Bonds6

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

N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[1-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]pyrrolidin-3-yl]acetamide (PubChem CID 71872471) has the molecular formula C17H25N5O3 and a molecular weight of 347.42 g/mol. Its IUPAC name is N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[1-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]pyrrolidin-3-yl]acetamide.

Molecular Properties

Compound NameN-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[1-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]pyrrolidin-3-yl]acetamide
PubChem CID71872471
Molecular FormulaC17H25N5O3
Molecular Weight347.42 g/mol
Exact Mass347.20
IUPAC NameN-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[1-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]pyrrolidin-3-yl]acetamide
SMILESCC(=O)N(Cc1noc(C)n1)C1CCN(Cc2ncc(C(C)C)o2)C1
InChIInChI=1S/C17H25N5O3/c1-11(2)15-7-18-17(24-15)10-21-6-5-14(8-21)22(13(4)23)9-16-19-12(3)25-20-16/h7,11,14H,5-6,8-10H2,1-4H3
InChIKeyAGJBNQJGKHPYGY-UHFFFAOYSA-N
XLogP2.11
TPSA88.50 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[1-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]pyrrolidin-3-yl]acetamide with MolForge

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Related Compounds

5-[1-[4-[(5-Tert-butyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]ethyl]-3-ethyl-1,2,4-oxadiazole
CID 53586459
N-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-1-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-amine
CID 53617861
N-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]-N-[1-[2-(1,2,4-triazol-1-yl)ethyl]pyrrolidin-3-yl]acetamide
CID 71872494
N-[1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrrolidin-3-yl]-N-[(5-methyl-1,3-oxazol-2-yl)methyl]acetamide
CID 71872522
1-[(5-ethyl-1,3-oxazol-2-yl)methyl]-N-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrrolidin-3-amine
CID 71872733
N-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-N-[1-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyrrolidin-3-yl]acetamide
CID 71928320
N-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]-N-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]acetamide
CID 71928339
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-N-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]acetamide
CID 71928356
1-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)methyl]-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-N-methylpyrrolidin-3-amine
CID 71928386
N-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-1-[(5-ethyl-1,3-oxazol-2-yl)methyl]-N-methylpyrrolidin-3-amine
CID 71928490
5-Cyclopropyl-3-[1-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole
CID 72122833
5-Methyl-3-[1-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole
CID 72135878

Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[1-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]pyrrolidin-3-yl]acetamide?
The IUPAC name of N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[1-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]pyrrolidin-3-yl]acetamide (CID 71872471) is N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[1-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]pyrrolidin-3-yl]acetamide.
What is the SMILES notation for N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[1-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]pyrrolidin-3-yl]acetamide?
The canonical SMILES for N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[1-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]pyrrolidin-3-yl]acetamide is CC(=O)N(Cc1noc(C)n1)C1CCN(Cc2ncc(C(C)C)o2)C1.
What is the InChIKey of N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[1-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]pyrrolidin-3-yl]acetamide?
The InChIKey is AGJBNQJGKHPYGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N5O3/c1-11(2)15-7-18-17(24-15)10-21-6-5-14(8-21)22(13(4)23)9-16-19-12(3)25-20-16/h7,11,14H,5-6,8-10H2,1-4H3.
What are the key properties of N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[1-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]pyrrolidin-3-yl]acetamide?
N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[1-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]pyrrolidin-3-yl]acetamide has a molecular weight of 347.42 g/mol, XLogP of 2.11, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[1-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]pyrrolidin-3-yl]acetamide is sourced from PubChem (CID 71872471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).