2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-propan-2-ylacetamide

C15H23N5O2 — CID 74245237

IUPAC2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-propan-2-ylacetamide
SMILESCCc1nnc(CN(C(=O)Cc2c(C)n[nH]c2C)C(C)C)o1
InChIInChI=1S/C15H23N5O2/c1-6-13-18-19-14(22-13)8-20(9(2)3)15(21)7-12-10(4)16-17-11(12)5/h9H,6-8H2,1-5H3,(H,16,17)
InChIKeyCCVYRJKYZQBUON-UHFFFAOYSA-N
MW305.38 g/mol
LogP1.95
Rot. Bonds6

About 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-propan-2-ylacetamide

2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-propan-2-ylacetamide (PubChem CID 74245237) has the molecular formula C15H23N5O2 and a molecular weight of 305.38 g/mol. Its IUPAC name is 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-propan-2-ylacetamide
PubChem CID74245237
Molecular FormulaC15H23N5O2
Molecular Weight305.38 g/mol
Exact Mass305.19
IUPAC Name2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-propan-2-ylacetamide
SMILESCCc1nnc(CN(C(=O)Cc2c(C)n[nH]c2C)C(C)C)o1
InChIInChI=1S/C15H23N5O2/c1-6-13-18-19-14(22-13)8-20(9(2)3)15(21)7-12-10(4)16-17-11(12)5/h9H,6-8H2,1-5H3,(H,16,17)
InChIKeyCCVYRJKYZQBUON-UHFFFAOYSA-N
XLogP1.95
TPSA87.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(2-pyrrolidin-1-ylethyl)acetamide
CID 70718457
2-Amino-2-(3,5-dimethyl-1H-pyrazol-4-YL)-N-{[1-(2-methoxyethyl)piperidin-4-YL]methyl}-N-methylacetamide
CID 70747717
1-(3,5-dimethyl-1H-pyrazol-4-yl)-2-oxo-2-[4-(3-pyrrolidin-1-ylpropyl)-1,4-diazepan-1-yl]ethanamine
CID 72918107
ethyl 2-[[1-[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]azetidin-3-yl]-methylamino]acetate
CID 126820318
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(3S)-1-ethyl-5-oxopyrrolidin-3-yl]acetamide
CID 164641681
(2S,4R)-4-Amino-1-[(3,5-dimethyl-1H-pyrazol-4-YL)methyl]-N-isopropylpyrrolidine-2-carboxamide
CID 56709160
2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-pyrrolidin-1-ylethanone
CID 60656289
methyl 1-[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]pyrrolidine-2-carboxylate
CID 43410299
methyl 2-[[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]-methylamino]acetate
CID 43422778
2-amino-N-[2-(dimethylamino)ethyl]-2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-ethylacetamide
CID 50955053
ethyl 2-[[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]-ethylamino]acetate
CID 54901269
methyl 2-[[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]-ethylamino]acetate
CID 54998319

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-propan-2-ylacetamide?
The IUPAC name of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-propan-2-ylacetamide (CID 74245237) is 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-propan-2-ylacetamide?
The canonical SMILES for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-propan-2-ylacetamide is CCc1nnc(CN(C(=O)Cc2c(C)n[nH]c2C)C(C)C)o1.
What is the InChIKey of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-propan-2-ylacetamide?
The InChIKey is CCVYRJKYZQBUON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O2/c1-6-13-18-19-14(22-13)8-20(9(2)3)15(21)7-12-10(4)16-17-11(12)5/h9H,6-8H2,1-5H3,(H,16,17).
What are the key properties of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-propan-2-ylacetamide?
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-propan-2-ylacetamide has a molecular weight of 305.38 g/mol, XLogP of 1.95, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-propan-2-ylacetamide is sourced from PubChem (CID 74245237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).