N-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-2-pyrazol-1-ylacetamide

C15H20N6O — CID 122356669

IUPACN-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-2-pyrazol-1-ylacetamide
SMILESCc1nc(N2CCCC2)nc(C)c1NC(=O)Cn1cccn1
InChIInChI=1S/C15H20N6O/c1-11-14(19-13(22)10-21-9-5-6-16-21)12(2)18-15(17-11)20-7-3-4-8-20/h5-6,9H,3-4,7-8,10H2,1-2H3,(H,19,22)
InChIKeyIUPULDBXMJSNGC-UHFFFAOYSA-N
MW300.37 g/mol
LogP1.53
Rot. Bonds4

About N-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-2-pyrazol-1-ylacetamide

N-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-2-pyrazol-1-ylacetamide (PubChem CID 122356669) has the molecular formula C15H20N6O and a molecular weight of 300.37 g/mol. Its IUPAC name is N-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-2-pyrazol-1-ylacetamide.

Molecular Properties

Compound NameN-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-2-pyrazol-1-ylacetamide
PubChem CID122356669
Molecular FormulaC15H20N6O
Molecular Weight300.37 g/mol
Exact Mass300.17
IUPAC NameN-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-2-pyrazol-1-ylacetamide
SMILESCc1nc(N2CCCC2)nc(C)c1NC(=O)Cn1cccn1
InChIInChI=1S/C15H20N6O/c1-11-14(19-13(22)10-21-9-5-6-16-21)12(2)18-15(17-11)20-7-3-4-8-20/h5-6,9H,3-4,7-8,10H2,1-2H3,(H,19,22)
InChIKeyIUPULDBXMJSNGC-UHFFFAOYSA-N
XLogP1.53
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.37
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-ethoxy-4,6-dimethylpyrimidin-5-yl)-2-pyrazol-1-ylacetamide
CID 122356086
2-pyrazol-1-yl-N-(4-pyrrolidin-1-ylphenyl)acetamide
CID 110689996
N-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-2-(4-fluorophenyl)acetamide
CID 71807259
2-pyrazol-1-yl-N-(2-pyrrolidin-1-ylphenyl)acetamide
CID 47126948
N-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-2-(3-methylphenyl)acetamide
CID 122356580
N-(2,6-dichlorophenyl)-2-pyrazol-1-ylacetamide
CID 110690005
N-[2-(2-fluorophenoxy)-4,6-dimethylpyrimidin-5-yl]-2-pyrazol-1-ylacetamide
CID 122303464
N-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-2,6-difluorobenzamide
CID 71807245
1-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-3-(2-methoxyphenyl)urea
CID 71807357
N-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-1-methyl-2-oxopyridine-3-carboxamide
CID 122356553
1-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-3-(4-methoxyphenyl)urea
CID 122356489
1-(3,4-dimethylphenyl)-3-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)urea
CID 122356497

Frequently Asked Questions

What is the IUPAC name of N-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-2-pyrazol-1-ylacetamide?
The IUPAC name of N-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-2-pyrazol-1-ylacetamide (CID 122356669) is N-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-2-pyrazol-1-ylacetamide.
What is the SMILES notation for N-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-2-pyrazol-1-ylacetamide?
The canonical SMILES for N-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-2-pyrazol-1-ylacetamide is Cc1nc(N2CCCC2)nc(C)c1NC(=O)Cn1cccn1.
What is the InChIKey of N-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-2-pyrazol-1-ylacetamide?
The InChIKey is IUPULDBXMJSNGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6O/c1-11-14(19-13(22)10-21-9-5-6-16-21)12(2)18-15(17-11)20-7-3-4-8-20/h5-6,9H,3-4,7-8,10H2,1-2H3,(H,19,22).
What are the key properties of N-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-2-pyrazol-1-ylacetamide?
N-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-2-pyrazol-1-ylacetamide has a molecular weight of 300.37 g/mol, XLogP of 1.53, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-2-pyrazol-1-ylacetamide is sourced from PubChem (CID 122356669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).