2-(4-aminopyrazol-1-yl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide

C11H19N5O2 — CID 61116168

IUPAC2-(4-aminopyrazol-1-yl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide
SMILESCCCNC(=O)CN(C)C(=O)Cn1cc(N)cn1
InChIInChI=1S/C11H19N5O2/c1-3-4-13-10(17)7-15(2)11(18)8-16-6-9(12)5-14-16/h5-6H,3-4,7-8,12H2,1-2H3,(H,13,17)
InChIKeyMOHPOCPWJHNGIR-UHFFFAOYSA-N
MW253.31 g/mol
LogP-0.55
Rot. Bonds6

About 2-(4-aminopyrazol-1-yl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide

2-(4-aminopyrazol-1-yl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide (PubChem CID 61116168) has the molecular formula C11H19N5O2 and a molecular weight of 253.31 g/mol. Its IUPAC name is 2-(4-aminopyrazol-1-yl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-aminopyrazol-1-yl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide
PubChem CID61116168
Molecular FormulaC11H19N5O2
Molecular Weight253.31 g/mol
Exact Mass253.15
IUPAC Name2-(4-aminopyrazol-1-yl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide
SMILESCCCNC(=O)CN(C)C(=O)Cn1cc(N)cn1
InChIInChI=1S/C11H19N5O2/c1-3-4-13-10(17)7-15(2)11(18)8-16-6-9(12)5-14-16/h5-6H,3-4,7-8,12H2,1-2H3,(H,13,17)
InChIKeyMOHPOCPWJHNGIR-UHFFFAOYSA-N
XLogP-0.55
TPSA93.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 5-0.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-aminopyrazol-1-yl)-N-methyl-N-(2-methylpropyl)acetamide
CID 43445500
2-(4-aminopyrazol-1-yl)-N,N-dipropylacetamide
CID 43445164
2-(5-amino-2-oxo-1-pyridinyl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide
CID 62814969
3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]-N,N-dimethylpropanamide
CID 61102926
2-[4-(3-aminopropyl)triazol-1-yl]-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide
CID 106220974
2-(2-aminophenyl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide
CID 61115422
2-(4-aminopyrazol-1-yl)-N-methyl-N-(2-propan-2-yloxyethyl)acetamide
CID 81053268
2-(4-aminopyrazol-1-yl)-N-[(4-fluorophenyl)methyl]-N-methylacetamide
CID 43574113
3,5-diamino-N-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 61115445
2-(3-aminoazetidin-1-yl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide
CID 65245071
2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)acetamide
CID 43445471
2-(4-aminopyrazol-1-yl)-N-cyclopropyl-N-propylacetamide
CID 43445497

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopyrazol-1-yl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide?
The IUPAC name of 2-(4-aminopyrazol-1-yl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide (CID 61116168) is 2-(4-aminopyrazol-1-yl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide.
What is the SMILES notation for 2-(4-aminopyrazol-1-yl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide?
The canonical SMILES for 2-(4-aminopyrazol-1-yl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide is CCCNC(=O)CN(C)C(=O)Cn1cc(N)cn1.
What is the InChIKey of 2-(4-aminopyrazol-1-yl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide?
The InChIKey is MOHPOCPWJHNGIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O2/c1-3-4-13-10(17)7-15(2)11(18)8-16-6-9(12)5-14-16/h5-6H,3-4,7-8,12H2,1-2H3,(H,13,17).
What are the key properties of 2-(4-aminopyrazol-1-yl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide?
2-(4-aminopyrazol-1-yl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide has a molecular weight of 253.31 g/mol, XLogP of -0.55, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopyrazol-1-yl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide is sourced from PubChem (CID 61116168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).