2-(5-amino-3-methylpyrazol-1-yl)-N-[(1-propan-2-ylimidazol-2-yl)methyl]acetamide

C13H20N6O — CID 91760917

IUPAC2-(5-amino-3-methylpyrazol-1-yl)-N-[(1-propan-2-ylimidazol-2-yl)methyl]acetamide
SMILESCc1cc(N)n(CC(=O)NCc2nccn2C(C)C)n1
InChIInChI=1S/C13H20N6O/c1-9(2)18-5-4-15-12(18)7-16-13(20)8-19-11(14)6-10(3)17-19/h4-6,9H,7-8,14H2,1-3H3,(H,16,20)
InChIKeyCWVZQMINWYNMNU-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.87
Rot. Bonds5

About 2-(5-amino-3-methylpyrazol-1-yl)-N-[(1-propan-2-ylimidazol-2-yl)methyl]acetamide

2-(5-amino-3-methylpyrazol-1-yl)-N-[(1-propan-2-ylimidazol-2-yl)methyl]acetamide (PubChem CID 91760917) 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-[(1-propan-2-ylimidazol-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(5-amino-3-methylpyrazol-1-yl)-N-[(1-propan-2-ylimidazol-2-yl)methyl]acetamide
PubChem CID91760917
Molecular FormulaC13H20N6O
Molecular Weight276.34 g/mol
Exact Mass276.17
IUPAC Name2-(5-amino-3-methylpyrazol-1-yl)-N-[(1-propan-2-ylimidazol-2-yl)methyl]acetamide
SMILESCc1cc(N)n(CC(=O)NCc2nccn2C(C)C)n1
InChIInChI=1S/C13H20N6O/c1-9(2)18-5-4-15-12(18)7-16-13(20)8-19-11(14)6-10(3)17-19/h4-6,9H,7-8,14H2,1-3H3,(H,16,20)
InChIKeyCWVZQMINWYNMNU-UHFFFAOYSA-N
XLogP0.87
TPSA90.76 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-{2-[1-(cyclopropylmethyl)-5-methyl-1H-imidazol-2-yl]ethyl}-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetamide
CID 91911715
N-[3-(1H-imidazol-1-yl)propyl]-3-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
CID 5299485
N-(3-imidazolylpropyl)-2-(5-methyl-3-nitropyrazolyl)acetamide
CID 3106249
N-(2,5-dimethylpyrazol-3-yl)-2-pyrazol-1-ylpropanamide
CID 45885693
N-[2-(3-methylbutan-2-yl)pyrazol-3-yl]-2-(2-propan-2-ylimidazol-1-yl)acetamide
CID 46983158
N-(3-tert-butyl-1-methylpyrazol-5-yl)-2-imidazol-1-ylacetamide
CID 46988872
N-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(4-methylimidazol-1-yl)acetamide
CID 46990430
2-(4-methylimidazol-1-yl)-N-(1-methyl-3-propan-2-ylpyrazol-5-yl)acetamide
CID 46996097
N-(2,5-dimethylpyrazol-3-yl)-2-[2-[(3,5-dimethyl-1,2,4-triazol-1-yl)methyl]pyrrolidin-1-yl]acetamide
CID 53571503
2-(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 53592824
2-(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(2-propylpyrazol-3-yl)acetamide
CID 53596665
2-(3,5-Dimethylpyrazol-1-yl)-1-[4-[(1-ethylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]ethanone
CID 53605638

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-3-methylpyrazol-1-yl)-N-[(1-propan-2-ylimidazol-2-yl)methyl]acetamide?
The IUPAC name of 2-(5-amino-3-methylpyrazol-1-yl)-N-[(1-propan-2-ylimidazol-2-yl)methyl]acetamide (CID 91760917) is 2-(5-amino-3-methylpyrazol-1-yl)-N-[(1-propan-2-ylimidazol-2-yl)methyl]acetamide.
What is the SMILES notation for 2-(5-amino-3-methylpyrazol-1-yl)-N-[(1-propan-2-ylimidazol-2-yl)methyl]acetamide?
The canonical SMILES for 2-(5-amino-3-methylpyrazol-1-yl)-N-[(1-propan-2-ylimidazol-2-yl)methyl]acetamide is Cc1cc(N)n(CC(=O)NCc2nccn2C(C)C)n1.
What is the InChIKey of 2-(5-amino-3-methylpyrazol-1-yl)-N-[(1-propan-2-ylimidazol-2-yl)methyl]acetamide?
The InChIKey is CWVZQMINWYNMNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N6O/c1-9(2)18-5-4-15-12(18)7-16-13(20)8-19-11(14)6-10(3)17-19/h4-6,9H,7-8,14H2,1-3H3,(H,16,20).
What are the key properties of 2-(5-amino-3-methylpyrazol-1-yl)-N-[(1-propan-2-ylimidazol-2-yl)methyl]acetamide?
2-(5-amino-3-methylpyrazol-1-yl)-N-[(1-propan-2-ylimidazol-2-yl)methyl]acetamide has a molecular weight of 276.34 g/mol, XLogP of 0.87, 5 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-[(1-propan-2-ylimidazol-2-yl)methyl]acetamide is sourced from PubChem (CID 91760917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).