2-(3-aminopyrazol-1-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]acetamide

C11H16N6O — CID 62112067

IUPAC2-(3-aminopyrazol-1-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]acetamide
SMILESCN(Cc1nccn1C)C(=O)Cn1ccc(N)n1
InChIInChI=1S/C11H16N6O/c1-15-6-4-13-10(15)7-16(2)11(18)8-17-5-3-9(12)14-17/h3-6H,7-8H2,1-2H3,(H2,12,14)
InChIKeyRGQSWCIRJRLECJ-UHFFFAOYSA-N
MW248.29 g/mol
LogP-0.14
Rot. Bonds4

About 2-(3-aminopyrazol-1-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]acetamide

2-(3-aminopyrazol-1-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]acetamide (PubChem CID 62112067) has the molecular formula C11H16N6O and a molecular weight of 248.29 g/mol. Its IUPAC name is 2-(3-aminopyrazol-1-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(3-aminopyrazol-1-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]acetamide
PubChem CID62112067
Molecular FormulaC11H16N6O
Molecular Weight248.29 g/mol
Exact Mass248.14
IUPAC Name2-(3-aminopyrazol-1-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]acetamide
SMILESCN(Cc1nccn1C)C(=O)Cn1ccc(N)n1
InChIInChI=1S/C11H16N6O/c1-15-6-4-13-10(15)7-16(2)11(18)8-17-5-3-9(12)14-17/h3-6H,7-8H2,1-2H3,(H2,12,14)
InChIKeyRGQSWCIRJRLECJ-UHFFFAOYSA-N
XLogP-0.14
TPSA81.97 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.29
LogP ≤ 5-0.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(3-aminopyrazol-1-yl)-N-[2-(dimethylamino)ethyl]-N-methylacetamide
CID 63693887
N-(2-amino-2-oxoethyl)-2-(3-aminopyrazol-1-yl)-N-methylacetamide
CID 62101394
1-[2-(1-methylimidazol-2-yl)ethyl]pyrazol-3-amine
CID 114527828
2-(3-aminopyrazol-1-yl)-N-(cyclopentylmethyl)-N-methylacetamide
CID 63630834
2-(3-aminopyrazol-1-yl)-N-[(4-bromothiophen-2-yl)methyl]-N-methylacetamide
CID 62112892
3-amino-N-methyl-N-[(1-methylimidazol-2-yl)methyl]-3-phenylpropanamide
CID 60962958
2-(3-aminopyrazol-1-yl)-N-methyl-N-[2-(methylamino)-2-oxoethyl]acetamide
CID 62101395
2-(3-aminopyrazol-1-yl)-N-(2-methoxyethyl)-N-methylacetamide
CID 62113912
5-amino-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide
CID 113383759
2-(3-aminopyrazol-1-yl)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-N-methylacetamide
CID 62111897
4-amino-1-ethyl-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazole-3-carboxamide
CID 65357912
2-(3-aminopyrazol-1-yl)-N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methylacetamide
CID 62111533

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminopyrazol-1-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]acetamide?
The IUPAC name of 2-(3-aminopyrazol-1-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]acetamide (CID 62112067) is 2-(3-aminopyrazol-1-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]acetamide.
What is the SMILES notation for 2-(3-aminopyrazol-1-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]acetamide?
The canonical SMILES for 2-(3-aminopyrazol-1-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]acetamide is CN(Cc1nccn1C)C(=O)Cn1ccc(N)n1.
What is the InChIKey of 2-(3-aminopyrazol-1-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]acetamide?
The InChIKey is RGQSWCIRJRLECJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N6O/c1-15-6-4-13-10(15)7-16(2)11(18)8-17-5-3-9(12)14-17/h3-6H,7-8H2,1-2H3,(H2,12,14).
What are the key properties of 2-(3-aminopyrazol-1-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]acetamide?
2-(3-aminopyrazol-1-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]acetamide has a molecular weight of 248.29 g/mol, XLogP of -0.14, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminopyrazol-1-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]acetamide is sourced from PubChem (CID 62112067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).