N-(2-cyclopentylpyrazol-3-yl)-2-[4-[6-(dimethylamino)pyrimidin-4-yl]pyrazol-1-yl]acetamide

C19H24N8O — CID 31193410

IUPACN-(2-cyclopentylpyrazol-3-yl)-2-[4-[6-(dimethylamino)pyrimidin-4-yl]pyrazol-1-yl]acetamide
SMILESCN(C)c1cc(-c2cnn(CC(=O)Nc3ccnn3C3CCCC3)c2)ncn1
InChIInChI=1S/C19H24N8O/c1-25(2)18-9-16(20-13-21-18)14-10-23-26(11-14)12-19(28)24-17-7-8-22-27(17)15-5-3-4-6-15/h7-11,13,15H,3-6,12H2,1-2H3,(H,24,28)
InChIKeyLRAYVZBAMZHLTJ-UHFFFAOYSA-N
MW380.46 g/mol
LogP2.36
Rot. Bonds6

About N-(2-cyclopentylpyrazol-3-yl)-2-[4-[6-(dimethylamino)pyrimidin-4-yl]pyrazol-1-yl]acetamide

N-(2-cyclopentylpyrazol-3-yl)-2-[4-[6-(dimethylamino)pyrimidin-4-yl]pyrazol-1-yl]acetamide (PubChem CID 31193410) has the molecular formula C19H24N8O and a molecular weight of 380.46 g/mol. Its IUPAC name is N-(2-cyclopentylpyrazol-3-yl)-2-[4-[6-(dimethylamino)pyrimidin-4-yl]pyrazol-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-cyclopentylpyrazol-3-yl)-2-[4-[6-(dimethylamino)pyrimidin-4-yl]pyrazol-1-yl]acetamide
PubChem CID31193410
Molecular FormulaC19H24N8O
Molecular Weight380.46 g/mol
Exact Mass380.21
IUPAC NameN-(2-cyclopentylpyrazol-3-yl)-2-[4-[6-(dimethylamino)pyrimidin-4-yl]pyrazol-1-yl]acetamide
SMILESCN(C)c1cc(-c2cnn(CC(=O)Nc3ccnn3C3CCCC3)c2)ncn1
InChIInChI=1S/C19H24N8O/c1-25(2)18-9-16(20-13-21-18)14-10-23-26(11-14)12-19(28)24-17-7-8-22-27(17)15-5-3-4-6-15/h7-11,13,15H,3-6,12H2,1-2H3,(H,24,28)
InChIKeyLRAYVZBAMZHLTJ-UHFFFAOYSA-N
XLogP2.36
TPSA93.76 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.46
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentylpyrazol-3-yl)-2-[4-[6-(dimethylamino)pyrimidin-4-yl]pyrazol-1-yl]acetamide?
The IUPAC name of N-(2-cyclopentylpyrazol-3-yl)-2-[4-[6-(dimethylamino)pyrimidin-4-yl]pyrazol-1-yl]acetamide (CID 31193410) is N-(2-cyclopentylpyrazol-3-yl)-2-[4-[6-(dimethylamino)pyrimidin-4-yl]pyrazol-1-yl]acetamide.
What is the SMILES notation for N-(2-cyclopentylpyrazol-3-yl)-2-[4-[6-(dimethylamino)pyrimidin-4-yl]pyrazol-1-yl]acetamide?
The canonical SMILES for N-(2-cyclopentylpyrazol-3-yl)-2-[4-[6-(dimethylamino)pyrimidin-4-yl]pyrazol-1-yl]acetamide is CN(C)c1cc(-c2cnn(CC(=O)Nc3ccnn3C3CCCC3)c2)ncn1.
What is the InChIKey of N-(2-cyclopentylpyrazol-3-yl)-2-[4-[6-(dimethylamino)pyrimidin-4-yl]pyrazol-1-yl]acetamide?
The InChIKey is LRAYVZBAMZHLTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N8O/c1-25(2)18-9-16(20-13-21-18)14-10-23-26(11-14)12-19(28)24-17-7-8-22-27(17)15-5-3-4-6-15/h7-11,13,15H,3-6,12H2,1-2H3,(H,24,28).
What are the key properties of N-(2-cyclopentylpyrazol-3-yl)-2-[4-[6-(dimethylamino)pyrimidin-4-yl]pyrazol-1-yl]acetamide?
N-(2-cyclopentylpyrazol-3-yl)-2-[4-[6-(dimethylamino)pyrimidin-4-yl]pyrazol-1-yl]acetamide has a molecular weight of 380.46 g/mol, XLogP of 2.36, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentylpyrazol-3-yl)-2-[4-[6-(dimethylamino)pyrimidin-4-yl]pyrazol-1-yl]acetamide is sourced from PubChem (CID 31193410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).