(2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]butanamide

C18H27N5O2 — CID 95610196

IUPAC(2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]butanamide
SMILESCCC(C(=O)Nc1cc(C)on1)N1CCC[C@@H]1c1c(C)nn(C)c1C
InChIInChI=1S/C18H27N5O2/c1-6-14(18(24)19-16-10-11(2)25-21-16)23-9-7-8-15(23)17-12(3)20-22(5)13(17)4/h10,14-15H,6-9H2,1-5H3,(H,19,21,24)/t14?,15-/m1/s1
InChIKeyHUNIPRDFFLNDEM-YSSOQSIOSA-N
MW345.45 g/mol
LogP2.89
Rot. Bonds5

About (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]butanamide

(2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]butanamide (PubChem CID 95610196) has the molecular formula C18H27N5O2 and a molecular weight of 345.45 g/mol. Its IUPAC name is (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]butanamide.

Molecular Properties

Compound Name(2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]butanamide
PubChem CID95610196
Molecular FormulaC18H27N5O2
Molecular Weight345.45 g/mol
Exact Mass345.22
IUPAC Name(2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]butanamide
SMILESCCC(C(=O)Nc1cc(C)on1)N1CCC[C@@H]1c1c(C)nn(C)c1C
InChIInChI=1S/C18H27N5O2/c1-6-14(18(24)19-16-10-11(2)25-21-16)23-9-7-8-15(23)17-12(3)20-22(5)13(17)4/h10,14-15H,6-9H2,1-5H3,(H,19,21,24)/t14?,15-/m1/s1
InChIKeyHUNIPRDFFLNDEM-YSSOQSIOSA-N
XLogP2.89
TPSA76.19 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.45
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]butanamide 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

(2S)-N-(3-methyl-1,2-oxazol-5-yl)-2-[(2S)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]propanamide
CID 129425645
(2R)-2-[(3S)-3-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]piperidin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)butanamide
CID 95282319
(2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(3R)-3-(5-methyl-1H-pyrazol-3-yl)piperidin-1-yl]butanamide
CID 100871755
(2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(3S)-3-(5-methyl-1H-pyrazol-3-yl)piperidin-1-yl]butanamide
CID 97025158
(2R)-N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[(3R)-2-oxoazepan-3-yl]piperazin-1-yl]butanamide
CID 95785782
(2S)-2-phenyl-2-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]acetamide
CID 95610209
2-[4-(4-methylbenzoyl)piperidin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)butanamide
CID 47060155
(2S)-2-[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)butanamide
CID 95288126
(2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(2S)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]propanamide
CID 129447804
(2R)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(2S)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]propanamide
CID 129447803
(2R)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenyl-2-[(2S)-2-thiophen-3-ylpyrrolidin-1-yl]acetamide
CID 124838744
N-(dicyclopropylmethyl)-2-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]acetamide
CID 95610221

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]butanamide?
The IUPAC name of (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]butanamide (CID 95610196) is (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]butanamide.
What is the SMILES notation for (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]butanamide?
The canonical SMILES for (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]butanamide is CCC(C(=O)Nc1cc(C)on1)N1CCC[C@@H]1c1c(C)nn(C)c1C.
What is the InChIKey of (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]butanamide?
The InChIKey is HUNIPRDFFLNDEM-YSSOQSIOSA-N. The full InChI is InChI=1S/C18H27N5O2/c1-6-14(18(24)19-16-10-11(2)25-21-16)23-9-7-8-15(23)17-12(3)20-22(5)13(17)4/h10,14-15H,6-9H2,1-5H3,(H,19,21,24)/t14?,15-/m1/s1.
What are the key properties of (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]butanamide?
(2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]butanamide has a molecular weight of 345.45 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]butanamide is sourced from PubChem (CID 95610196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).