3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]-N,N-dimethylpropanamide

C10H17N5O2 — CID 61102926

IUPAC3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]-N,N-dimethylpropanamide
SMILESCN(C)C(=O)CCNC(=O)Cn1cc(N)cn1
InChIInChI=1S/C10H17N5O2/c1-14(2)10(17)3-4-12-9(16)7-15-6-8(11)5-13-15/h5-6H,3-4,7,11H2,1-2H3,(H,12,16)
InChIKeyHYBAFFIESDSRAH-UHFFFAOYSA-N
MW239.28 g/mol
LogP-0.94
Rot. Bonds5

About 3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]-N,N-dimethylpropanamide

3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]-N,N-dimethylpropanamide (PubChem CID 61102926) has the molecular formula C10H17N5O2 and a molecular weight of 239.28 g/mol. Its IUPAC name is 3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]-N,N-dimethylpropanamide
PubChem CID61102926
Molecular FormulaC10H17N5O2
Molecular Weight239.28 g/mol
Exact Mass239.14
IUPAC Name3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]-N,N-dimethylpropanamide
SMILESCN(C)C(=O)CCNC(=O)Cn1cc(N)cn1
InChIInChI=1S/C10H17N5O2/c1-14(2)10(17)3-4-12-9(16)7-15-6-8(11)5-13-15/h5-6H,3-4,7,11H2,1-2H3,(H,12,16)
InChIKeyHYBAFFIESDSRAH-UHFFFAOYSA-N
XLogP-0.94
TPSA93.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 5-0.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)acetamide
CID 43445471
2-(4-aminopyrazol-1-yl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide
CID 61116168
2-(4-aminopyrazol-1-yl)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]acetamide
CID 62843765
2-[[2-(4-aminopyrazol-1-yl)acetyl]amino]ethyl carbamate
CID 83201957
2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide
CID 43185729
2-(4-aminopyrazol-1-yl)-N-[3-(methanesulfonamido)propyl]acetamide
CID 114174718
tert-butyl N-[3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]propyl]carbamate
CID 114517811
2-(4-aminopyrazol-1-yl)-N-[3-[ethyl(methylsulfonyl)amino]propyl]acetamide
CID 61139822
2-(4-aminopyrazol-1-yl)-N-(3-hydroxy-4-methoxybutyl)acetamide
CID 114162948
N-[2-(4-aminopyrazol-1-yl)ethyl]-2-methylsulfonylacetamide
CID 115319573
2-(4-aminopyrazol-1-yl)-N-methyl-N-(2-methylpropyl)acetamide
CID 43445500
2-(4-aminopyrazol-1-yl)-N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]acetamide
CID 63328749

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]-N,N-dimethylpropanamide?
The IUPAC name of 3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]-N,N-dimethylpropanamide (CID 61102926) is 3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]-N,N-dimethylpropanamide.
What is the SMILES notation for 3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]-N,N-dimethylpropanamide?
The canonical SMILES for 3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]-N,N-dimethylpropanamide is CN(C)C(=O)CCNC(=O)Cn1cc(N)cn1.
What is the InChIKey of 3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]-N,N-dimethylpropanamide?
The InChIKey is HYBAFFIESDSRAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O2/c1-14(2)10(17)3-4-12-9(16)7-15-6-8(11)5-13-15/h5-6H,3-4,7,11H2,1-2H3,(H,12,16).
What are the key properties of 3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]-N,N-dimethylpropanamide?
3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]-N,N-dimethylpropanamide has a molecular weight of 239.28 g/mol, XLogP of -0.94, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]-N,N-dimethylpropanamide is sourced from PubChem (CID 61102926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).