N-methyl-2-[(2-pyrimidin-4-yl-1H-imidazol-5-yl)amino]acetamide

C10H12N6O — CID 59698703

IUPACN-methyl-2-[(2-pyrimidin-4-yl-1H-imidazol-5-yl)amino]acetamide
SMILESCNC(=O)CNc1cnc(-c2ccncn2)[nH]1
InChIInChI=1S/C10H12N6O/c1-11-9(17)5-13-8-4-14-10(16-8)7-2-3-12-6-15-7/h2-4,6,13H,5H2,1H3,(H,11,17)(H,14,16)
InChIKeyOVCLGWWLBGKWDT-UHFFFAOYSA-N
MW232.25 g/mol
LogP0.02
Rot. Bonds4

About N-methyl-2-[(2-pyrimidin-4-yl-1H-imidazol-5-yl)amino]acetamide

N-methyl-2-[(2-pyrimidin-4-yl-1H-imidazol-5-yl)amino]acetamide (PubChem CID 59698703) has the molecular formula C10H12N6O and a molecular weight of 232.25 g/mol. Its IUPAC name is N-methyl-2-[(2-pyrimidin-4-yl-1H-imidazol-5-yl)amino]acetamide.

Molecular Properties

Compound NameN-methyl-2-[(2-pyrimidin-4-yl-1H-imidazol-5-yl)amino]acetamide
PubChem CID59698703
Molecular FormulaC10H12N6O
Molecular Weight232.25 g/mol
Exact Mass232.11
IUPAC NameN-methyl-2-[(2-pyrimidin-4-yl-1H-imidazol-5-yl)amino]acetamide
SMILESCNC(=O)CNc1cnc(-c2ccncn2)[nH]1
InChIInChI=1S/C10H12N6O/c1-11-9(17)5-13-8-4-14-10(16-8)7-2-3-12-6-15-7/h2-4,6,13H,5H2,1H3,(H,11,17)(H,14,16)
InChIKeyOVCLGWWLBGKWDT-UHFFFAOYSA-N
XLogP0.02
TPSA95.59 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.25
LogP ≤ 50.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(1H-imidazol-5-yl)ethyl]pyrimidin-2-amine
CID 10012717
2-(1H-imidazol-5-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone
CID 110684121
4-(1H-imidazol-2-yl)pyrimidine
CID 18536665
1-{2-[2-(2-isopropylpyrimidin-4-yl)-1H-imidazol-1-yl]ethyl}imidazolidin-2-one
CID 56866012
6-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]pyrimidin-4-amine
CID 61225702
2-[[2-(dimethylamino)pyrimidin-4-yl]methyl-methylamino]-N-propylacetamide
CID 75400681
N-{1-[(2-Ethylpyrimidin-4-YL)methyl]pyrrolidin-3-YL}acetamide
CID 77087153
2-isopropyl-N-[(1-methyl-1H-imidazol-2-yl)methyl]pyrimidine-4-carboxamide
CID 119070905
4-[6-[1H-imidazol-2-ylmethyl(methyl)amino]pyrimidin-4-yl]-1-methylpiperazin-2-one
CID 128095125
4-methyl-N-[(3S)-5-oxopyrrolidin-3-yl]pyrimidine-2-carboxamide
CID 164631208
2,4-difluoro-6-(1H-imidazol-2-yl)pyrimidine
CID 22324127
N-ethyl-N-(1H-imidazol-5-ylmethyl)-4-(trifluoromethyl)pyrimidin-2-amine
CID 59728254

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(2-pyrimidin-4-yl-1H-imidazol-5-yl)amino]acetamide?
The IUPAC name of N-methyl-2-[(2-pyrimidin-4-yl-1H-imidazol-5-yl)amino]acetamide (CID 59698703) is N-methyl-2-[(2-pyrimidin-4-yl-1H-imidazol-5-yl)amino]acetamide.
What is the SMILES notation for N-methyl-2-[(2-pyrimidin-4-yl-1H-imidazol-5-yl)amino]acetamide?
The canonical SMILES for N-methyl-2-[(2-pyrimidin-4-yl-1H-imidazol-5-yl)amino]acetamide is CNC(=O)CNc1cnc(-c2ccncn2)[nH]1.
What is the InChIKey of N-methyl-2-[(2-pyrimidin-4-yl-1H-imidazol-5-yl)amino]acetamide?
The InChIKey is OVCLGWWLBGKWDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N6O/c1-11-9(17)5-13-8-4-14-10(16-8)7-2-3-12-6-15-7/h2-4,6,13H,5H2,1H3,(H,11,17)(H,14,16).
What are the key properties of N-methyl-2-[(2-pyrimidin-4-yl-1H-imidazol-5-yl)amino]acetamide?
N-methyl-2-[(2-pyrimidin-4-yl-1H-imidazol-5-yl)amino]acetamide has a molecular weight of 232.25 g/mol, XLogP of 0.02, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(2-pyrimidin-4-yl-1H-imidazol-5-yl)amino]acetamide is sourced from PubChem (CID 59698703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).