2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-pyrrolidin-1-ylbutyl]acetamide

C15H25N3O2 — CID 51658024

IUPAC2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-pyrrolidin-1-ylbutyl]acetamide
SMILESCC[C@@H](CNC(=O)Cc1c(C)noc1C)N1CCCC1
InChIInChI=1S/C15H25N3O2/c1-4-13(18-7-5-6-8-18)10-16-15(19)9-14-11(2)17-20-12(14)3/h13H,4-10H2,1-3H3,(H,16,19)/t13-/m0/s1
InChIKeyZSZOYLPKEXXUCM-ZDUSSCGKSA-N
MW279.38 g/mol
LogP1.82
Rot. Bonds6

About 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-pyrrolidin-1-ylbutyl]acetamide

2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-pyrrolidin-1-ylbutyl]acetamide (PubChem CID 51658024) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-pyrrolidin-1-ylbutyl]acetamide.

Molecular Properties

Compound Name2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-pyrrolidin-1-ylbutyl]acetamide
PubChem CID51658024
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-pyrrolidin-1-ylbutyl]acetamide
SMILESCC[C@@H](CNC(=O)Cc1c(C)noc1C)N1CCCC1
InChIInChI=1S/C15H25N3O2/c1-4-13(18-7-5-6-8-18)10-16-15(19)9-14-11(2)17-20-12(14)3/h13H,4-10H2,1-3H3,(H,16,19)/t13-/m0/s1
InChIKeyZSZOYLPKEXXUCM-ZDUSSCGKSA-N
XLogP1.82
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-pyrrolidin-1-ylbutyl]acetamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(2-cyclopropyl-2-hydroxyethyl)-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 63294569
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(pyrrolidin-2-ylmethyl)acetamide
CID 55084624
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2-hydroxycyclohexyl)methyl]acetamide
CID 64929090
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide
CID 31325172
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(2-hydroxypropylamino)ethyl]acetamide
CID 104593398
3-[[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]amino]-2-phenylpropanoic acid
CID 119254605
3-[[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]amino]propanoic acid
CID 16770026
N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 119525893
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide
CID 111119841
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 107845762
N-[2-(dimethylamino)-2-oxoethyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 31337042
N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 43019628

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-pyrrolidin-1-ylbutyl]acetamide?
The IUPAC name of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-pyrrolidin-1-ylbutyl]acetamide (CID 51658024) is 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-pyrrolidin-1-ylbutyl]acetamide.
What is the SMILES notation for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-pyrrolidin-1-ylbutyl]acetamide?
The canonical SMILES for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-pyrrolidin-1-ylbutyl]acetamide is CC[C@@H](CNC(=O)Cc1c(C)noc1C)N1CCCC1.
What is the InChIKey of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-pyrrolidin-1-ylbutyl]acetamide?
The InChIKey is ZSZOYLPKEXXUCM-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-4-13(18-7-5-6-8-18)10-16-15(19)9-14-11(2)17-20-12(14)3/h13H,4-10H2,1-3H3,(H,16,19)/t13-/m0/s1.
What are the key properties of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-pyrrolidin-1-ylbutyl]acetamide?
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-pyrrolidin-1-ylbutyl]acetamide has a molecular weight of 279.38 g/mol, XLogP of 1.82, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-pyrrolidin-1-ylbutyl]acetamide is sourced from PubChem (CID 51658024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).