5-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]imidazo[1,2-c]pyrimidine-7-carboxylic acid

C15H17N7O2 — CID 167942127

IUPAC5-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]imidazo[1,2-c]pyrimidine-7-carboxylic acid
SMILESCn1cc(N2CCN(c3nc(C(=O)O)cc4nccn34)CC2)cn1
InChIInChI=1S/C15H17N7O2/c1-19-10-11(9-17-19)20-4-6-21(7-5-20)15-18-12(14(23)24)8-13-16-2-3-22(13)15/h2-3,8-10H,4-7H2,1H3,(H,23,24)
InChIKeyGEWSYYTVBPKBQF-UHFFFAOYSA-N
MW327.35 g/mol
LogP0.49
Rot. Bonds3

About 5-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]imidazo[1,2-c]pyrimidine-7-carboxylic acid

5-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]imidazo[1,2-c]pyrimidine-7-carboxylic acid (PubChem CID 167942127) has the molecular formula C15H17N7O2 and a molecular weight of 327.35 g/mol. Its IUPAC name is 5-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]imidazo[1,2-c]pyrimidine-7-carboxylic acid.

Molecular Properties

Compound Name5-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]imidazo[1,2-c]pyrimidine-7-carboxylic acid
PubChem CID167942127
Molecular FormulaC15H17N7O2
Molecular Weight327.35 g/mol
Exact Mass327.14
IUPAC Name5-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]imidazo[1,2-c]pyrimidine-7-carboxylic acid
SMILESCn1cc(N2CCN(c3nc(C(=O)O)cc4nccn34)CC2)cn1
InChIInChI=1S/C15H17N7O2/c1-19-10-11(9-17-19)20-4-6-21(7-5-20)15-18-12(14(23)24)8-13-16-2-3-22(13)15/h2-3,8-10H,4-7H2,1H3,(H,23,24)
InChIKeyGEWSYYTVBPKBQF-UHFFFAOYSA-N
XLogP0.49
TPSA91.79 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.35
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

5-(1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)imidazo[1,2-c]pyrimidine-7-carboxylic acid
CID 167780587
5-(1-pyrimidin-2-yl-4,6-dihydropyrrolo[3,4-d]pyrazol-5-yl)imidazo[1,2-c]pyrimidine-7-carboxylic acid
CID 167972639
5-[7-(hydroxymethyl)-5-azaspiro[3.4]octan-5-yl]imidazo[1,2-c]pyrimidine-7-carboxylic acid
CID 167885370
5-[3-[(pyridin-2-ylamino)methyl]pyrrolidin-1-yl]imidazo[1,2-c]pyrimidine-7-carboxylic acid
CID 167929901
N-methyl-1-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]piperidin-3-amine;hydrochloride
CID 163302339
5-[[4-(trifluoromethyl)cyclohexyl]amino]imidazo[1,2-c]pyrimidine-7-carboxylic acid
CID 167952304
4-[(1-methylpyrazol-4-yl)methylsulfanyl]pyridine-2-carboxylic acid
CID 79555153
5-[4-(1-methylpyrazol-4-yl)-3-oxopiperazin-1-yl]pyrazine-2-carboxylic acid
CID 122054198
1-methyl-2-pyrrolidin-1-ylimidazole-4-carboxylic acid
CID 117189298
7-(3,4-dimethoxyphenyl)-5-[4-(4-methylphenyl)piperazin-1-yl]imidazo[1,2-c]pyrimidine
CID 20805928
2-methyl-3-(methylamino)-1-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]propan-1-one
CID 119887328
1-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]-2-propan-2-ylpentan-1-one
CID 126767368

Frequently Asked Questions

What is the IUPAC name of 5-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]imidazo[1,2-c]pyrimidine-7-carboxylic acid?
The IUPAC name of 5-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]imidazo[1,2-c]pyrimidine-7-carboxylic acid (CID 167942127) is 5-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]imidazo[1,2-c]pyrimidine-7-carboxylic acid.
What is the SMILES notation for 5-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]imidazo[1,2-c]pyrimidine-7-carboxylic acid?
The canonical SMILES for 5-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]imidazo[1,2-c]pyrimidine-7-carboxylic acid is Cn1cc(N2CCN(c3nc(C(=O)O)cc4nccn34)CC2)cn1.
What is the InChIKey of 5-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]imidazo[1,2-c]pyrimidine-7-carboxylic acid?
The InChIKey is GEWSYYTVBPKBQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N7O2/c1-19-10-11(9-17-19)20-4-6-21(7-5-20)15-18-12(14(23)24)8-13-16-2-3-22(13)15/h2-3,8-10H,4-7H2,1H3,(H,23,24).
What are the key properties of 5-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]imidazo[1,2-c]pyrimidine-7-carboxylic acid?
5-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]imidazo[1,2-c]pyrimidine-7-carboxylic acid has a molecular weight of 327.35 g/mol, XLogP of 0.49, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]imidazo[1,2-c]pyrimidine-7-carboxylic acid is sourced from PubChem (CID 167942127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).