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

C12H21N5O2 — CID 63301328

IUPAC2-[methyl(pyrrolidin-3-yl)amino]-N-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)acetamide
SMILESCC(C)c1nnc(NC(=O)CN(C)C2CCNC2)o1
InChIInChI=1S/C12H21N5O2/c1-8(2)11-15-16-12(19-11)14-10(18)7-17(3)9-4-5-13-6-9/h8-9,13H,4-7H2,1-3H3,(H,14,16,18)
InChIKeyGPLYEUIJMNTQDL-UHFFFAOYSA-N
MW267.33 g/mol
LogP0.43
Rot. Bonds5

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

2-[methyl(pyrrolidin-3-yl)amino]-N-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)acetamide (PubChem CID 63301328) has the molecular formula C12H21N5O2 and a molecular weight of 267.33 g/mol. Its IUPAC name is 2-[methyl(pyrrolidin-3-yl)amino]-N-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-[methyl(pyrrolidin-3-yl)amino]-N-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)acetamide
PubChem CID63301328
Molecular FormulaC12H21N5O2
Molecular Weight267.33 g/mol
Exact Mass267.17
IUPAC Name2-[methyl(pyrrolidin-3-yl)amino]-N-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)acetamide
SMILESCC(C)c1nnc(NC(=O)CN(C)C2CCNC2)o1
InChIInChI=1S/C12H21N5O2/c1-8(2)11-15-16-12(19-11)14-10(18)7-17(3)9-4-5-13-6-9/h8-9,13H,4-7H2,1-3H3,(H,14,16,18)
InChIKeyGPLYEUIJMNTQDL-UHFFFAOYSA-N
XLogP0.43
TPSA83.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[methyl(pyrrolidin-3-yl)amino]-N-(2-propan-2-ylphenyl)acetamide
CID 63297765
N-(4-methylphenyl)-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119922897
2-[methyl(pyrrolidin-3-yl)amino]-N-(1,3-thiazol-2-yl)acetamide
CID 63301676
2-[methyl(pyrrolidin-3-yl)amino]-N-(2,4,5-trichlorophenyl)acetamide
CID 63298307
2-[tert-butyl-[2-oxo-2-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)amino]ethyl]amino]acetic acid
CID 79263253
2-[methyl(pyrrolidin-3-yl)amino]-N-(2,4,5-trichlorophenyl)acetamide;hydrochloride
CID 119922827
2-[methyl(pyrrolidin-3-yl)amino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide;hydrochloride
CID 119922868
N-(2,4-dibromophenyl)-2-[methyl(pyrrolidin-3-yl)amino]acetamide
CID 63301508
N-(2-acetamidoethyl)-2-[methyl(pyrrolidin-3-yl)amino]acetamide
CID 63301776
N-cyclohexyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119922828
N-(2-ethoxyphenyl)-2-[methyl(pyrrolidin-3-yl)amino]acetamide
CID 63298223
2-(3-aminoazetidin-1-yl)-N-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)acetamide
CID 65249493

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(pyrrolidin-3-yl)amino]-N-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)acetamide?
The IUPAC name of 2-[methyl(pyrrolidin-3-yl)amino]-N-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)acetamide (CID 63301328) is 2-[methyl(pyrrolidin-3-yl)amino]-N-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)acetamide.
What is the SMILES notation for 2-[methyl(pyrrolidin-3-yl)amino]-N-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)acetamide?
The canonical SMILES for 2-[methyl(pyrrolidin-3-yl)amino]-N-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)acetamide is CC(C)c1nnc(NC(=O)CN(C)C2CCNC2)o1.
What is the InChIKey of 2-[methyl(pyrrolidin-3-yl)amino]-N-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)acetamide?
The InChIKey is GPLYEUIJMNTQDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O2/c1-8(2)11-15-16-12(19-11)14-10(18)7-17(3)9-4-5-13-6-9/h8-9,13H,4-7H2,1-3H3,(H,14,16,18).
What are the key properties of 2-[methyl(pyrrolidin-3-yl)amino]-N-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)acetamide?
2-[methyl(pyrrolidin-3-yl)amino]-N-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)acetamide has a molecular weight of 267.33 g/mol, XLogP of 0.43, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(pyrrolidin-3-yl)amino]-N-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)acetamide is sourced from PubChem (CID 63301328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).