2-(5-amino-3-methylpyrazol-1-yl)-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]acetamide

C13H20N6O — CID 99985610

IUPAC2-(5-amino-3-methylpyrazol-1-yl)-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]acetamide
SMILESCc1cc(N)n(CC(=O)N[C@@H](C)CCn2cccn2)n1
InChIInChI=1S/C13H20N6O/c1-10(4-7-18-6-3-5-15-18)16-13(20)9-19-12(14)8-11(2)17-19/h3,5-6,8,10H,4,7,9,14H2,1-2H3,(H,16,20)/t10-/m0/s1
InChIKeyLASDOAXMXKBUMA-JTQLQIEISA-N
MW276.34 g/mol
LogP0.57
Rot. Bonds6

About 2-(5-amino-3-methylpyrazol-1-yl)-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]acetamide

2-(5-amino-3-methylpyrazol-1-yl)-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]acetamide (PubChem CID 99985610) has the molecular formula C13H20N6O and a molecular weight of 276.34 g/mol. Its IUPAC name is 2-(5-amino-3-methylpyrazol-1-yl)-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]acetamide.

Molecular Properties

Compound Name2-(5-amino-3-methylpyrazol-1-yl)-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]acetamide
PubChem CID99985610
Molecular FormulaC13H20N6O
Molecular Weight276.34 g/mol
Exact Mass276.17
IUPAC Name2-(5-amino-3-methylpyrazol-1-yl)-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]acetamide
SMILESCc1cc(N)n(CC(=O)N[C@@H](C)CCn2cccn2)n1
InChIInChI=1S/C13H20N6O/c1-10(4-7-18-6-3-5-15-18)16-13(20)9-19-12(14)8-11(2)17-19/h3,5-6,8,10H,4,7,9,14H2,1-2H3,(H,16,20)/t10-/m0/s1
InChIKeyLASDOAXMXKBUMA-JTQLQIEISA-N
XLogP0.57
TPSA90.76 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-(5-amino-3-methylpyrazol-1-yl)-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(5-amino-3-methylpyrazol-1-yl)-N-[(2R)-1-imidazol-1-ylbutan-2-yl]acetamide
CID 99984955
(2R)-2-[[2-(5-amino-3-methylpyrazol-1-yl)acetyl]amino]-4-methylsulfanylbutanoic acid
CID 126447208
2-(3-methyl-N-methylsulfonylanilino)-N-(4-pyrazol-1-ylbutan-2-yl)acetamide
CID 91792054
N-[(1R)-1-(1-adamantyl)propyl]-2-(5-amino-3-methylpyrazol-1-yl)acetamide
CID 124751289
N-butan-2-yl-2-[5-(difluoromethyl)-3-methylpyrazol-1-yl]acetamide
CID 19516578
2-(5-amino-3-methylpyrazol-1-yl)-N-[cyclopropyl-(2-methyl-1,2,4-triazol-3-yl)methyl]acetamide
CID 91790852
2-(2-ethyl-4-methyl-6-oxo-1H-pyrimidin-5-yl)-N-(4-pyrazol-1-ylbutan-2-yl)acetamide
CID 136662139
N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)acetamide
CID 115977436
N-butan-2-yl-2-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]acetamide
CID 19521887
ethyl 2-(propan-2-ylamino)-4-pyrazol-1-ylbutanoate
CID 55144911
2-methyl-6-(3-pyrazol-1-ylpropanoylamino)heptanoic acid
CID 65285915
ethyl 2-(5-amino-3-methylpyrazol-1-yl)acetate;hydrochloride
CID 75485346

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-3-methylpyrazol-1-yl)-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]acetamide?
The IUPAC name of 2-(5-amino-3-methylpyrazol-1-yl)-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]acetamide (CID 99985610) is 2-(5-amino-3-methylpyrazol-1-yl)-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]acetamide.
What is the SMILES notation for 2-(5-amino-3-methylpyrazol-1-yl)-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]acetamide?
The canonical SMILES for 2-(5-amino-3-methylpyrazol-1-yl)-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]acetamide is Cc1cc(N)n(CC(=O)N[C@@H](C)CCn2cccn2)n1.
What is the InChIKey of 2-(5-amino-3-methylpyrazol-1-yl)-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]acetamide?
The InChIKey is LASDOAXMXKBUMA-JTQLQIEISA-N. The full InChI is InChI=1S/C13H20N6O/c1-10(4-7-18-6-3-5-15-18)16-13(20)9-19-12(14)8-11(2)17-19/h3,5-6,8,10H,4,7,9,14H2,1-2H3,(H,16,20)/t10-/m0/s1.
What are the key properties of 2-(5-amino-3-methylpyrazol-1-yl)-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]acetamide?
2-(5-amino-3-methylpyrazol-1-yl)-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]acetamide has a molecular weight of 276.34 g/mol, XLogP of 0.57, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-3-methylpyrazol-1-yl)-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]acetamide is sourced from PubChem (CID 99985610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).