N-(1H-imidazol-2-ylmethyl)-2-(1H-pyrazol-5-yl)acetamide

C9H11N5O — CID 79139019

IUPACN-(1H-imidazol-2-ylmethyl)-2-(1H-pyrazol-5-yl)acetamide
SMILESO=C(Cc1ccn[nH]1)NCc1ncc[nH]1
InChIInChI=1S/C9H11N5O/c15-9(5-7-1-2-13-14-7)12-6-8-10-3-4-11-8/h1-4H,5-6H2,(H,10,11)(H,12,15)(H,13,14)
InChIKeyADLYIYPVLXKTOY-UHFFFAOYSA-N
MW205.22 g/mol
LogP-0.01
Rot. Bonds4

About N-(1H-imidazol-2-ylmethyl)-2-(1H-pyrazol-5-yl)acetamide

N-(1H-imidazol-2-ylmethyl)-2-(1H-pyrazol-5-yl)acetamide (PubChem CID 79139019) has the molecular formula C9H11N5O and a molecular weight of 205.22 g/mol. Its IUPAC name is N-(1H-imidazol-2-ylmethyl)-2-(1H-pyrazol-5-yl)acetamide.

Molecular Properties

Compound NameN-(1H-imidazol-2-ylmethyl)-2-(1H-pyrazol-5-yl)acetamide
PubChem CID79139019
Molecular FormulaC9H11N5O
Molecular Weight205.22 g/mol
Exact Mass205.10
IUPAC NameN-(1H-imidazol-2-ylmethyl)-2-(1H-pyrazol-5-yl)acetamide
SMILESO=C(Cc1ccn[nH]1)NCc1ncc[nH]1
InChIInChI=1S/C9H11N5O/c15-9(5-7-1-2-13-14-7)12-6-8-10-3-4-11-8/h1-4H,5-6H2,(H,10,11)(H,12,15)(H,13,14)
InChIKeyADLYIYPVLXKTOY-UHFFFAOYSA-N
XLogP-0.01
TPSA86.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 5-0.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-aminophenyl)-N-(1H-imidazol-2-ylmethyl)acetamide
CID 64517782
N-(1H-imidazol-2-ylmethyl)-2-pyridin-2-ylacetamide
CID 64529840
2-(1H-pyrazol-5-yl)-N-(1H-pyrrol-3-ylmethyl)acetamide
CID 106385153
2-[2-(aminomethyl)phenyl]-N-(1H-imidazol-2-ylmethyl)acetamide
CID 81321885
2-[2-(1H-imidazol-2-ylmethylamino)-2-oxoethyl]benzoic acid
CID 104601596
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(1H-imidazol-2-ylmethyl)acetamide
CID 64532408
2-(1H-pyrazol-5-yl)-N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]acetamide
CID 112528731
2-acetamido-N-(1H-imidazol-2-ylmethyl)acetamide
CID 64531448
N-methyl-2-(1H-pyrazol-5-yl)acetamide
CID 79004016
2-(1H-pyrazol-5-yl)acetohydrazide
CID 4196186
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-(1H-pyrazol-5-yl)acetamide
CID 112528463
N-[[3-(hydroxymethyl)phenyl]methyl]-2-(1H-pyrazol-5-yl)acetamide
CID 79040356

Frequently Asked Questions

What is the IUPAC name of N-(1H-imidazol-2-ylmethyl)-2-(1H-pyrazol-5-yl)acetamide?
The IUPAC name of N-(1H-imidazol-2-ylmethyl)-2-(1H-pyrazol-5-yl)acetamide (CID 79139019) is N-(1H-imidazol-2-ylmethyl)-2-(1H-pyrazol-5-yl)acetamide.
What is the SMILES notation for N-(1H-imidazol-2-ylmethyl)-2-(1H-pyrazol-5-yl)acetamide?
The canonical SMILES for N-(1H-imidazol-2-ylmethyl)-2-(1H-pyrazol-5-yl)acetamide is O=C(Cc1ccn[nH]1)NCc1ncc[nH]1.
What is the InChIKey of N-(1H-imidazol-2-ylmethyl)-2-(1H-pyrazol-5-yl)acetamide?
The InChIKey is ADLYIYPVLXKTOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5O/c15-9(5-7-1-2-13-14-7)12-6-8-10-3-4-11-8/h1-4H,5-6H2,(H,10,11)(H,12,15)(H,13,14).
What are the key properties of N-(1H-imidazol-2-ylmethyl)-2-(1H-pyrazol-5-yl)acetamide?
N-(1H-imidazol-2-ylmethyl)-2-(1H-pyrazol-5-yl)acetamide has a molecular weight of 205.22 g/mol, XLogP of -0.01, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-imidazol-2-ylmethyl)-2-(1H-pyrazol-5-yl)acetamide is sourced from PubChem (CID 79139019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).