N-(2-methoxyethyl)-2-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]acetamide

C12H17N5O2 — CID 104732076

IUPACN-(2-methoxyethyl)-2-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]acetamide
SMILESCOCCNC(=O)CNc1nccn2nc(C)cc12
InChIInChI=1S/C12H17N5O2/c1-9-7-10-12(14-3-5-17(10)16-9)15-8-11(18)13-4-6-19-2/h3,5,7H,4,6,8H2,1-2H3,(H,13,18)(H,14,15)
InChIKeyBFKHJHIJMAOCAC-UHFFFAOYSA-N
MW263.30 g/mol
LogP0.21
Rot. Bonds6

About N-(2-methoxyethyl)-2-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]acetamide

N-(2-methoxyethyl)-2-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]acetamide (PubChem CID 104732076) has the molecular formula C12H17N5O2 and a molecular weight of 263.30 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]acetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]acetamide
PubChem CID104732076
Molecular FormulaC12H17N5O2
Molecular Weight263.30 g/mol
Exact Mass263.14
IUPAC NameN-(2-methoxyethyl)-2-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]acetamide
SMILESCOCCNC(=O)CNc1nccn2nc(C)cc12
InChIInChI=1S/C12H17N5O2/c1-9-7-10-12(14-3-5-17(10)16-9)15-8-11(18)13-4-6-19-2/h3,5,7H,4,6,8H2,1-2H3,(H,13,18)(H,14,15)
InChIKeyBFKHJHIJMAOCAC-UHFFFAOYSA-N
XLogP0.21
TPSA80.55 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N'-(2-methoxyethyl)-N'-methyl-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)ethane-1,2-diamine
CID 104731385
2-methyl-N-(2-propan-2-yloxyethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104762381
2-[(3-amino-4-methyl-2-pyridinyl)amino]-N-(2-methoxyethyl)acetamide
CID 113405011
N-(4-methoxybutan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 104731642
2-[(7-hydroxyisoquinolin-1-yl)amino]-N-(2-methoxyethyl)acetamide
CID 106539384
N-(2,2-dimethylpropyl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 104730931
N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)-N'-propan-2-ylethane-1,2-diamine
CID 113446460
2-[(3-chloro-2-pyridinyl)amino]-N-(2-methoxyethyl)acetamide
CID 115575489
2-methyl-N-(3-phenoxypropyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104731310
methyl 2-[(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)amino]acetate
CID 104730488
4-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]benzoic acid
CID 104729300
N-(1-chloro-3-methoxypropan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 106181719

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]acetamide?
The IUPAC name of N-(2-methoxyethyl)-2-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]acetamide (CID 104732076) is N-(2-methoxyethyl)-2-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]acetamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]acetamide?
The canonical SMILES for N-(2-methoxyethyl)-2-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]acetamide is COCCNC(=O)CNc1nccn2nc(C)cc12.
What is the InChIKey of N-(2-methoxyethyl)-2-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]acetamide?
The InChIKey is BFKHJHIJMAOCAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O2/c1-9-7-10-12(14-3-5-17(10)16-9)15-8-11(18)13-4-6-19-2/h3,5,7H,4,6,8H2,1-2H3,(H,13,18)(H,14,15).
What are the key properties of N-(2-methoxyethyl)-2-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]acetamide?
N-(2-methoxyethyl)-2-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]acetamide has a molecular weight of 263.30 g/mol, XLogP of 0.21, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]acetamide is sourced from PubChem (CID 104732076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).